#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3max s LYS 13 N 0.00 4.37 0.14 0.00 1.02 -1.26 -5.05 119.74 118.96 3max s LYS 13 Ca 0.00 1.50 0.06 0.00 0.02 0.00 0.00 55.97 57.54 3max s LYS 13 Cb 0.00 -2.72 -0.04 0.00 -0.52 0.00 0.00 37.83 34.55 3max s LYS 13 CO 0.00 0.04 0.02 0.15 -0.92 0.00 0.00 175.35 174.65 3max s LYS 14 N -2.20 2.55 0.00 1.68 -0.14 -1.26 -5.08 119.74 115.29 3max s LYS 14 Ca 0.53 -0.95 -0.30 0.00 -1.36 0.00 0.00 55.97 53.89 3max s LYS 14 Cb -0.22 -2.49 -0.03 0.00 -1.68 0.00 0.00 37.83 33.41 3max s LYS 14 CO 0.28 0.49 0.99 0.21 -0.76 0.00 0.00 175.35 176.57 3max s LYS 15 N -2.72 4.55 -0.14 1.68 2.20 -1.26 -4.92 119.74 119.14 3max s LYS 15 Ca 0.27 1.44 0.02 0.00 -0.36 0.00 0.00 55.97 57.35 3max s LYS 15 Cb -0.10 -3.45 0.01 0.00 -1.51 0.00 0.00 37.83 32.77 3max s LYS 15 CO 0.19 -0.06 -0.22 0.08 -0.36 0.00 0.00 175.35 174.98 3max s VAL 16 N 1.02 2.11 -0.12 4.02 1.01 -1.26 -1.21 120.40 125.97 3max s VAL 16 Ca 0.52 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 3max s VAL 16 Cb -0.21 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 3max s VAL 16 CO 0.28 0.55 -0.05 0.00 0.00 0.00 0.00 175.10 175.88 3max s TYR 18 N -0.15 1.63 -0.17 0.00 6.14 -0.04 -0.58 117.35 124.18 3max s TYR 18 Ca 0.02 -0.60 -0.04 0.00 0.64 0.00 0.00 57.07 57.10 3max s TYR 18 Cb -0.13 -1.16 -0.03 0.00 0.42 0.00 0.00 41.96 41.07 3max s TYR 18 CO 0.03 -0.28 -0.02 0.71 0.64 0.00 0.00 175.55 176.62 3max s TYR 19 N 0.53 3.03 -0.19 4.97 1.51 0.32 0.07 117.35 127.59 3max s TYR 19 Ca -0.14 -0.36 -0.15 0.00 -1.01 0.00 0.00 57.07 55.42 3max s TYR 19 Cb -0.15 -2.00 0.05 0.00 -0.11 0.00 0.00 41.96 39.75 3max s TYR 19 CO 0.04 -0.11 0.49 -0.47 -1.11 0.00 0.00 175.55 174.39 3max s TYR 20 N 0.59 -0.62 -0.17 2.71 6.14 -0.14 -4.45 117.35 121.41 3max s TYR 20 Ca -0.02 1.40 0.01 0.00 0.64 0.00 0.00 57.07 59.11 3max s TYR 20 Cb -0.14 0.26 0.02 0.00 0.42 0.00 0.00 41.96 42.52 3max s TYR 20 CO 0.02 -0.32 -0.20 0.34 0.64 0.00 0.00 175.55 176.04 3max s ASP 21 N 0.76 3.07 0.48 4.32 3.68 -1.26 -4.03 116.67 123.70 3max s ASP 21 Ca -0.04 -0.62 0.33 0.00 2.13 0.00 0.00 52.55 54.35 3max s ASP 21 Cb -0.05 -1.44 1.70 0.00 -1.45 0.00 0.00 42.92 41.68 3max s ASP 21 CO -0.06 0.02 2.00 1.23 0.13 0.00 0.00 175.17 178.49 3max h GLY 22 N 7.79 0.00 2.00 2.66 0.00 -2.00 -1.65 103.07 111.86 3max h GLY 22 Ca -0.42 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.87 3max h GLY 22 CO 0.61 0.00 -0.21 -0.55 0.00 0.00 0.00 176.54 176.39 3max h ASP 23 N 0.00 0.00 -0.89 0.19 3.45 -2.03 -3.31 116.42 113.83 3max h ASP 23 Ca 0.00 0.00 0.24 0.00 0.43 0.00 0.00 57.03 57.70 3max h ASP 23 Cb 0.10 0.00 -0.14 0.00 -0.56 0.00 0.00 39.33 38.74 3max h ASP 23 CO 0.00 0.21 0.33 -0.29 -1.57 0.00 0.00 179.24 177.91 3max h ILE 24 N 0.00 0.37 0.00 0.35 6.09 -1.69 -1.01 117.51 121.62 3max h ILE 24 Ca -0.00 -0.10 0.00 0.00 -1.37 0.00 0.00 64.86 63.39 3max h ILE 24 Cb 0.59 0.06 0.00 0.00 0.47 0.00 0.00 36.82 37.94 3max h ILE 24 CO 0.03 0.05 0.00 0.61 -3.07 0.00 0.00 178.15 175.77 3max n GLY 25 N -1.35 -1.00 0.00 8.18 0.00 -1.25 -2.74 105.19 107.04 3max n GLY 25 Ca 0.23 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.34 3max n GLY 25 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3max n ASN 26 N -1.59 0.46 -4.76 1.61 3.02 -0.38 -3.92 115.26 109.69 3max n ASN 26 Ca 0.03 -0.19 -0.39 0.00 -0.03 0.00 0.00 54.58 54.00 3max n ASN 26 Cb 0.17 0.17 -0.05 0.00 -0.61 0.00 0.00 39.78 39.46 3max n ASN 26 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3max s TYR 27 N -2.99 3.69 -0.14 3.10 1.51 -1.11 -5.04 117.35 116.37 3max s TYR 27 Ca 0.12 1.77 -0.02 0.00 -1.01 0.00 0.00 57.07 57.93 3max s TYR 27 Cb 0.18 -3.13 0.05 0.00 -0.11 0.00 0.00 41.96 38.94 3max s TYR 27 CO 0.68 -0.16 0.01 -0.47 -1.11 0.00 0.00 175.55 174.50 3max s TYR 28 N -1.27 0.93 -0.44 2.71 5.04 -1.26 -4.27 117.35 118.79 3max s TYR 28 Ca 0.45 -0.59 0.24 0.00 -2.44 0.00 0.00 57.07 54.73 3max s TYR 28 Cb -0.28 -0.96 1.01 0.00 0.35 0.00 0.00 41.96 42.08 3max s TYR 28 CO 0.35 -0.50 1.72 0.66 -1.34 0.00 0.00 175.55 176.45 3max n TYR 29 N 5.08 0.86 0.00 4.97 0.53 -1.26 -4.72 117.16 122.62 3max n TYR 29 Ca -0.08 0.34 0.00 0.00 -1.02 0.00 0.00 57.90 57.13 3max n TYR 29 Cb 0.48 -1.05 0.00 0.00 -1.03 0.00 0.00 39.34 37.75 3max n TYR 29 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 3max n GLY 30 N -0.04 2.82 3.69 2.72 0.00 -1.26 -4.83 105.19 108.29 3max n GLY 30 Ca 0.02 -2.03 -0.44 0.00 0.00 0.00 0.00 46.02 43.57 3max n GLY 30 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3max n GLN 31 N -0.52 2.40 0.00 1.61 7.27 -1.26 -2.01 117.38 124.87 3max n GLN 31 Ca 0.00 0.86 0.00 0.00 0.07 0.00 0.00 57.00 57.93 3max n GLN 31 Cb 0.00 -2.66 0.00 0.00 2.41 0.00 0.00 30.24 29.99 3max n GLN 31 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3max n GLY 32 N 3.54 2.77 3.69 1.69 0.00 -1.26 -4.99 105.19 110.63 3max n GLY 32 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3max n GLY 32 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3max s HIS 33 N -2.23 2.53 0.14 1.61 2.46 -0.85 -4.92 115.29 114.03 3max s HIS 33 Ca 0.00 0.47 0.34 0.00 0.47 0.00 0.00 55.06 56.34 3max s HIS 33 Cb 0.00 -3.87 1.52 0.00 -0.13 0.00 0.00 32.58 30.10 3max s HIS 33 CO 0.00 -3.42 2.02 -1.00 -2.47 0.00 0.00 174.74 169.87 3max h PRO 34 N 8.24 0.00 -6.10 2.88 0.13 -1.94 -3.43 132.00 131.77 3max h PRO 34 Ca -0.41 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.15 3max h PRO 34 Cb 1.19 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 3max h PRO 34 CO 0.92 0.00 0.83 1.41 -0.23 0.00 0.00 178.00 180.93 3max s MET 35 N -3.72 4.25 -0.39 0.86 -2.45 -1.26 -4.81 119.30 111.79 3max s MET 35 Ca 0.00 1.46 0.02 0.00 -1.25 0.00 0.00 55.69 55.92 3max s MET 35 Cb 0.10 -3.68 0.11 0.00 1.25 0.00 0.00 34.83 32.61 3max s MET 35 CO 0.49 -0.65 0.15 0.15 1.05 0.00 0.00 175.02 176.21 3max s LYS 36 N 3.28 1.28 0.60 4.11 1.02 -1.26 -4.45 119.74 124.31 3max s LYS 36 Ca 0.48 -1.79 0.29 0.00 0.02 0.00 0.00 55.97 54.96 3max s LYS 36 Cb -0.17 -2.63 1.54 0.00 -0.52 0.00 0.00 37.83 36.04 3max s LYS 36 CO 0.09 -1.04 1.95 -1.35 -0.92 0.00 0.00 175.35 174.08 3max h PRO 37 N 7.35 0.00 -1.02 -1.68 0.11 -1.86 -0.40 132.00 134.50 3max h PRO 37 Ca -0.07 0.00 0.29 0.00 0.11 0.00 0.00 66.00 66.33 3max h PRO 37 Cb 0.97 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.04 3max h PRO 37 CO 0.52 0.00 0.72 1.25 -0.21 0.00 0.00 178.00 180.28 3max h HIS 38 N 0.00 0.09 -0.27 0.65 -0.00 -1.78 -0.19 115.15 113.64 3max h HIS 38 Ca 0.16 0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.61 3max h HIS 38 Cb 0.94 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 28.32 3max h HIS 38 CO 0.00 0.01 0.26 0.07 -0.00 0.00 0.00 177.93 178.27 3max h ARG 39 N 0.06 0.00 -0.10 5.26 0.11 -1.43 -1.20 114.38 117.07 3max h ARG 39 Ca 0.49 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 60.36 3max h ARG 39 Cb 1.87 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.96 3max h ARG 39 CO -0.04 0.00 -0.81 0.82 0.10 0.00 0.00 179.97 180.04 3max h ILE 40 N 0.00 1.32 -0.52 0.08 1.08 -1.25 -1.47 117.51 116.75 3max h ILE 40 Ca 0.13 -2.09 -0.07 0.00 -0.39 0.00 0.00 64.86 62.43 3max h ILE 40 Cb 0.64 2.10 -0.02 0.00 -3.07 0.00 0.00 36.82 36.48 3max h ILE 40 CO -0.00 0.65 0.03 -0.09 -0.69 0.00 0.00 178.15 178.05 3max h ARG 41 N 0.42 0.89 -0.33 2.37 2.43 -1.38 -1.06 114.38 117.73 3max h ARG 41 Ca -0.06 -0.27 0.02 0.00 -0.81 0.00 0.00 59.98 58.87 3max h ARG 41 Cb 1.42 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.86 3max h ARG 41 CO 0.16 0.90 0.16 0.52 -1.51 0.00 0.00 179.97 180.20 3max h MET 42 N 0.77 0.33 0.01 0.20 2.86 -1.30 0.21 114.93 118.01 3max h MET 42 Ca 0.15 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.79 3max h MET 42 Cb 0.48 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.04 3max h MET 42 CO 0.02 0.22 -0.13 1.15 1.06 0.00 0.00 176.91 179.22 3max h THR 43 N 0.34 0.67 -0.35 2.22 2.02 -1.13 -0.75 112.91 115.93 3max h THR 43 Ca 0.14 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.34 3max h THR 43 Cb 0.05 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 3max h THR 43 CO -0.09 0.00 0.19 -0.74 0.37 0.00 0.00 175.52 175.24 3max h HIS 44 N -0.23 0.35 -0.75 3.16 6.17 -0.83 -1.38 115.15 121.64 3max h HIS 44 Ca 0.04 0.01 -0.04 0.00 0.71 0.00 0.00 60.37 61.09 3max h HIS 44 Cb 0.28 -0.11 -0.03 0.00 2.52 0.00 0.00 27.41 30.08 3max h HIS 44 CO -0.19 0.19 0.29 -0.97 0.71 0.00 0.00 177.93 177.97 3max h ASN 45 N 0.38 1.03 -0.07 3.26 -0.73 -0.38 -1.52 115.58 117.56 3max h ASN 45 Ca 0.14 -0.17 -0.00 0.00 1.87 0.00 0.00 56.30 58.14 3max h ASN 45 Cb 0.04 -0.27 -0.00 0.00 0.27 0.00 0.00 38.32 38.35 3max h ASN 45 CO -0.09 0.93 0.04 0.25 -0.37 0.00 0.00 177.43 178.18 3max h LEU 46 N 1.08 0.09 -1.14 0.34 5.85 -0.90 -2.21 115.31 118.42 3max h LEU 46 Ca 0.25 -0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.77 3max h LEU 46 Cb 0.22 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3max h LEU 46 CO -0.02 0.18 -0.42 0.17 -0.34 0.00 0.00 178.44 178.01 3max h LEU 47 N -0.00 0.00 -0.70 2.25 8.10 -1.07 -1.90 115.31 121.99 3max h LEU 47 Ca 0.02 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.93 3max h LEU 47 Cb 0.11 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.30 3max h LEU 47 CO -0.00 0.42 0.10 -0.07 -4.11 0.00 0.00 178.44 174.77 3max h LEU 48 N 0.00 1.06 -1.25 0.17 3.38 -1.20 -2.43 115.31 115.04 3max h LEU 48 Ca -0.00 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 3max h LEU 48 Cb 0.77 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3max h LEU 48 CO 0.05 1.05 -0.24 0.78 0.09 0.00 0.00 178.44 180.17 3max h ASN 49 N 1.03 0.00 0.14 -0.43 2.35 -0.75 -1.22 115.58 116.70 3max h ASN 49 Ca 0.20 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 3max h ASN 49 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.82 3max h ASN 49 CO 0.01 0.24 0.00 -1.22 -1.65 0.00 0.00 177.43 174.81 3max n TYR 50 N -3.49 0.00 -1.01 1.19 4.01 -0.78 -4.86 117.16 112.22 3max n TYR 50 Ca -0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.73 3max n TYR 50 Cb 0.41 -0.08 -0.00 0.00 -0.31 0.00 0.00 39.34 39.36 3max n TYR 50 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3max n GLY 51 N 0.88 0.47 0.26 2.72 0.00 -0.46 -4.94 105.19 104.12 3max n GLY 51 Ca 0.19 -0.27 0.17 0.00 0.00 0.00 0.00 46.02 46.12 3max n GLY 51 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3max h LEU 52 N 0.00 0.00 -2.33 0.99 3.38 -1.63 -1.95 115.31 113.77 3max h LEU 52 Ca -0.01 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.00 3max h LEU 52 Cb 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3max h LEU 52 CO 0.01 0.00 0.16 0.10 0.09 0.00 0.00 178.44 178.81 3max h TYR 53 N 0.00 0.00 0.00 1.13 -0.00 -1.85 -2.12 116.97 114.14 3max h TYR 53 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.71 3max h TYR 53 Cb 0.28 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.01 3max h TYR 53 CO 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 178.16 178.05 3max h ARG 54 N 0.00 0.00 -0.01 0.10 3.08 -1.75 -3.22 114.38 112.59 3max h ARG 54 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3max h ARG 54 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 3max h ARG 54 CO -0.00 0.11 -0.36 1.63 -1.07 0.00 0.00 179.97 180.28 3max n LYS 55 N -3.31 1.87 -4.09 0.04 4.76 -0.80 -5.02 118.16 111.61 3max n LYS 55 Ca -0.00 -0.64 -0.08 0.00 -2.87 0.00 0.00 58.31 54.72 3max n LYS 55 Cb 0.33 -1.22 -0.10 0.00 -1.84 0.00 0.00 35.03 32.20 3max n LYS 55 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3max s MET 56 N -1.86 0.71 -0.11 1.97 0.23 -1.22 -4.74 119.30 114.28 3max s MET 56 Ca 0.11 -1.27 -0.21 0.00 -1.03 0.00 0.00 55.69 53.29 3max s MET 56 Cb 0.12 0.23 -0.04 0.00 -1.53 0.00 0.00 34.83 33.61 3max s MET 56 CO 0.40 -0.16 0.60 -1.21 -2.03 0.00 0.00 175.02 172.62 3max s GLU 57 N -3.95 4.35 -0.23 3.16 2.02 -0.77 -4.85 118.70 118.42 3max s GLU 57 Ca 0.12 0.66 -0.07 0.00 0.02 0.00 0.00 54.97 55.69 3max s GLU 57 Cb 0.08 -3.47 -0.03 0.00 0.10 0.00 0.00 34.13 30.81 3max s GLU 57 CO -0.07 0.03 0.06 0.42 0.02 0.00 0.00 175.26 175.72 3max s ILE 58 N 0.97 4.31 0.07 -1.63 1.01 -1.26 -0.86 121.20 123.81 3max s ILE 58 Ca 0.31 -0.18 0.07 0.00 0.00 0.00 0.00 60.65 60.85 3max s ILE 58 Cb -0.16 -2.99 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 3max s ILE 58 CO 0.13 0.37 -0.14 -0.31 0.00 0.00 0.00 174.94 174.99 3max s TYR 59 N 1.35 2.65 -0.27 3.97 2.02 0.11 -4.95 117.35 122.22 3max s TYR 59 Ca 0.05 -0.20 -0.13 0.00 -0.37 0.00 0.00 57.07 56.42 3max s TYR 59 Cb -0.15 -1.45 -0.04 0.00 -0.40 0.00 0.00 41.96 39.92 3max s TYR 59 CO 0.03 0.35 0.28 0.50 -1.57 0.00 0.00 175.55 175.14 3max s ARG 60 N -1.82 3.99 0.66 -0.62 3.52 -1.26 -0.97 118.95 122.46 3max s ARG 60 Ca 0.18 -0.14 -0.13 0.00 -0.13 0.00 0.00 55.73 55.51 3max s ARG 60 Cb -0.11 -3.65 -0.00 0.00 -1.56 0.00 0.00 34.95 29.63 3max s ARG 60 CO 0.09 -0.22 1.07 -1.25 -0.81 0.00 0.00 175.30 174.18 3max s PRO 61 N 1.89 2.94 0.77 5.12 0.04 -1.26 -4.95 135.00 139.54 3max s PRO 61 Ca 0.11 1.16 -0.11 0.00 0.04 0.00 0.00 61.00 62.20 3max s PRO 61 Cb -0.16 -1.98 0.05 0.00 0.04 0.00 0.00 34.50 32.45 3max s PRO 61 CO 0.10 -1.11 1.09 -3.38 0.04 0.00 0.00 177.00 173.74 3max s HIS 62 N -2.67 2.94 -0.45 0.56 -3.43 -1.26 -4.92 115.29 106.06 3max s HIS 62 Ca 0.62 1.17 -0.29 0.00 -0.80 0.00 0.00 55.06 55.76 3max s HIS 62 Cb -0.16 -3.09 0.03 0.00 -1.43 0.00 0.00 32.58 27.93 3max s HIS 62 CO 0.46 -1.62 1.15 0.15 -2.00 0.00 0.00 174.74 172.88 3max s LYS 63 N -5.17 3.77 0.32 -0.38 1.02 -1.26 -4.19 119.74 113.85 3max s LYS 63 Ca 0.60 0.68 -0.29 0.00 0.02 0.00 0.00 55.97 56.98 3max s LYS 63 Cb -0.14 -3.89 -0.12 0.00 -0.52 0.00 0.00 37.83 33.16 3max s LYS 63 CO 0.54 -1.32 1.38 0.00 -0.92 0.00 0.00 175.35 175.02 3max n ALA 64 N 7.77 1.59 -2.12 5.17 0.00 -1.00 -4.99 120.51 126.94 3max n ALA 64 Ca 0.12 0.37 -0.23 0.00 0.00 0.00 0.00 53.44 53.70 3max n ALA 64 Cb 0.49 -2.31 0.03 0.00 0.00 0.00 0.00 19.45 17.66 3max n ALA 64 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3max s THR 65 N -0.79 3.28 0.39 0.00 -4.23 -1.26 -4.69 115.64 108.33 3max s THR 65 Ca 0.58 -0.48 0.12 0.00 -1.18 0.00 0.00 61.69 60.73 3max s THR 65 Cb -0.56 -3.24 0.34 0.00 1.34 0.00 0.00 72.50 70.38 3max s THR 65 CO 0.59 -0.19 1.89 0.00 -0.54 0.00 0.00 174.62 176.37 3max h ALA 66 N 0.11 1.98 -0.14 3.99 0.00 -1.98 -0.89 119.26 122.33 3max h ALA 66 Ca -0.44 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.50 3max h ALA 66 Cb 1.28 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 3max h ALA 66 CO 0.56 -0.20 -0.02 0.93 0.00 0.00 0.00 179.25 180.52 3max h GLU 67 N 0.56 0.02 -0.14 0.00 5.08 -1.97 0.58 114.58 118.71 3max h GLU 67 Ca 0.42 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.79 3max h GLU 67 Cb 0.80 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 3max h GLU 67 CO -0.17 0.02 0.04 0.93 -1.00 0.00 0.00 179.01 178.83 3max h GLU 68 N 0.02 0.10 -0.42 2.33 5.08 -1.62 -3.04 114.58 117.03 3max h GLU 68 Ca 0.06 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 3max h GLU 68 Cb 0.09 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3max h GLU 68 CO -0.12 0.06 -0.13 0.52 -1.00 0.00 0.00 179.01 178.34 3max h MET 69 N 0.10 0.76 0.00 2.33 2.86 -0.94 -2.54 114.93 117.50 3max h MET 69 Ca 0.06 -0.26 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 3max h MET 69 Cb 0.05 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.65 3max h MET 69 CO -0.07 0.86 0.00 0.25 1.06 0.00 0.00 176.91 179.00 3max n THR 70 N -4.16 0.00 0.30 2.22 -2.24 0.17 -1.35 114.28 109.23 3max n THR 70 Ca 0.01 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 61.98 3max n THR 70 Cb 0.38 -0.32 0.87 0.00 -2.10 0.00 0.00 70.33 69.15 3max n THR 70 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3max h LYS 71 N 0.00 0.00 0.00 -0.78 1.79 -1.39 -3.38 116.57 112.81 3max h LYS 71 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3max h LYS 71 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3max h LYS 71 CO 0.00 0.00 -0.60 0.98 -1.08 0.00 0.00 179.45 178.76 3max n TYR 72 N -3.10 0.00 -2.20 -1.35 4.19 -0.91 -5.07 117.16 108.73 3max n TYR 72 Ca -0.01 0.00 -0.33 0.00 3.31 0.00 0.00 57.90 60.88 3max n TYR 72 Cb 0.23 0.19 -0.01 0.00 0.49 0.00 0.00 39.34 40.24 3max n TYR 72 CO 0.00 0.00 0.00 -1.01 0.91 0.00 0.00 176.86 176.76 3max s HIS 73 N -1.98 3.08 0.47 2.98 3.76 -0.46 -4.84 115.29 118.31 3max s HIS 73 Ca 0.00 1.51 -0.23 0.00 -0.15 0.00 0.00 55.06 56.20 3max s HIS 73 Cb 0.00 -2.97 -0.07 0.00 1.11 0.00 0.00 32.58 30.64 3max s HIS 73 CO 0.00 -0.92 1.18 -1.54 -0.85 0.00 0.00 174.74 172.61 3max s SER 74 N -2.71 6.08 0.30 1.40 1.04 -0.95 -4.23 113.70 114.63 3max s SER 74 Ca 0.63 2.33 0.05 0.00 0.48 0.00 0.00 55.95 59.44 3max s SER 74 Cb -0.15 -2.60 0.69 0.00 0.10 0.00 0.00 66.02 64.06 3max s SER 74 CO 0.33 -0.98 1.80 0.44 0.98 0.00 0.00 173.24 175.81 3max h ASP 75 N 1.96 0.83 -0.32 7.02 3.45 -1.94 -2.01 116.42 125.42 3max h ASP 75 Ca -0.49 0.08 -0.07 0.00 0.43 0.00 0.00 57.03 56.98 3max h ASP 75 Cb 1.25 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 39.94 3max h ASP 75 CO 0.60 0.35 -0.06 -0.33 -1.57 0.00 0.00 179.24 178.22 3max h GLU 76 N 0.83 0.60 -0.28 3.56 3.07 -1.98 -0.20 114.58 120.18 3max h GLU 76 Ca 0.55 -0.22 -0.01 0.00 -0.50 0.00 0.00 59.36 59.17 3max h GLU 76 Cb 0.77 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.63 3max h GLU 76 CO -0.33 0.78 0.12 -0.92 -1.40 0.00 0.00 179.01 177.25 3max h TYR 77 N 0.38 0.42 -0.43 4.33 3.20 -1.84 -1.35 116.97 121.67 3max h TYR 77 Ca 0.08 -0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.85 3max h TYR 77 Cb 0.55 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 3max h TYR 77 CO 0.05 0.41 -0.02 0.82 -1.64 0.00 0.00 178.16 177.77 3max h ILE 78 N 0.30 1.26 -0.82 1.81 1.08 -1.29 -1.16 117.51 118.69 3max h ILE 78 Ca 0.09 -1.08 0.07 0.00 -0.39 0.00 0.00 64.86 63.55 3max h ILE 78 Cb 0.16 1.09 -0.06 0.00 -3.07 0.00 0.00 36.82 34.94 3max h ILE 78 CO -0.01 0.37 0.50 0.50 -0.69 0.00 0.00 178.15 178.82 3max h LYS 79 N 0.62 0.86 -0.03 2.37 3.64 -0.95 -0.47 116.57 122.61 3max h LYS 79 Ca 0.12 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 3max h LYS 79 Cb 0.53 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 3max h LYS 79 CO 0.03 0.57 -0.01 0.35 -2.27 0.00 0.00 179.45 178.12 3max h PHE 80 N 0.89 -0.02 -0.55 1.91 3.04 -0.92 -2.06 116.94 119.24 3max h PHE 80 Ca 0.37 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.32 3max h PHE 80 Cb 0.22 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 38.72 3max h PHE 80 CO -0.04 -0.01 0.34 -0.07 -2.02 0.00 0.00 178.31 176.50 3max h LEU 81 N 0.00 0.64 -1.51 0.59 3.38 -0.54 -0.29 115.31 117.57 3max h LEU 81 Ca 0.02 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3max h LEU 81 Cb 0.02 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 3max h LEU 81 CO -0.03 0.48 -0.13 0.03 0.09 0.00 0.00 178.44 178.88 3max h ARG 82 N 0.74 0.00 0.00 1.13 3.08 -0.83 -3.34 114.38 115.16 3max h ARG 82 Ca 0.20 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.88 3max h ARG 82 Cb -0.05 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 29.93 3max h ARG 82 CO -0.04 0.13 -2.41 0.43 -1.07 0.00 0.00 179.97 177.01 3max n SER 83 N -3.36 1.09 -4.72 7.04 7.64 -0.60 -5.00 113.62 115.71 3max n SER 83 Ca -0.00 -0.07 -0.42 0.00 1.01 0.00 0.00 58.87 59.39 3max n SER 83 Cb 0.33 0.28 -0.03 0.00 -1.01 0.00 0.00 64.21 63.78 3max n SER 83 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 3max s ILE 84 N -2.49 3.17 0.05 0.44 1.10 -0.22 -4.99 121.20 118.25 3max s ILE 84 Ca -0.22 0.84 -0.01 0.00 -0.51 0.00 0.00 60.65 60.75 3max s ILE 84 Cb 0.07 -3.54 -0.04 0.00 0.15 0.00 0.00 42.46 39.11 3max s ILE 84 CO 0.70 0.07 -0.03 -0.13 -2.11 0.00 0.00 174.94 173.43 3max s ARG 85 N 1.11 0.55 0.49 3.50 0.52 -1.26 -4.91 118.95 118.96 3max s ARG 85 Ca 0.66 -1.08 0.16 0.00 -0.52 0.00 0.00 55.73 54.94 3max s ARG 85 Cb -0.38 0.16 1.18 0.00 0.52 0.00 0.00 34.95 36.43 3max s ARG 85 CO 0.30 -0.09 2.06 -1.35 0.02 0.00 0.00 175.30 176.25 3max h PRO 86 N 3.49 0.17 0.00 3.54 0.11 -1.85 -1.93 132.00 135.53 3max h PRO 86 Ca -0.34 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3max h PRO 86 Cb 1.16 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3max h PRO 86 CO 0.60 0.11 0.00 0.38 -0.21 0.00 0.00 178.00 178.88 3max h ASP 87 N 0.18 0.00 -0.04 -2.05 2.03 -1.99 -3.28 116.42 111.27 3max h ASP 87 Ca 0.14 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 3max h ASP 87 Cb 0.34 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.84 3max h ASP 87 CO -0.02 0.00 0.00 -0.46 -1.03 0.00 0.00 179.24 177.73 3max n ASN 88 N -2.53 2.21 -0.27 4.15 0.23 -0.78 -4.80 115.26 113.48 3max n ASN 88 Ca 0.04 -2.22 0.02 0.00 -0.53 0.00 0.00 54.58 51.89 3max n ASN 88 Cb 0.39 -0.11 0.15 0.00 -2.08 0.00 0.00 39.78 38.12 3max n ASN 88 CO 0.00 0.00 0.00 0.24 -0.93 0.00 0.00 177.26 176.57 3max h MET 89 N 0.25 0.65 -0.08 -3.83 2.86 -1.47 -2.27 114.93 111.04 3max h MET 89 Ca 0.00 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3max h MET 89 Cb 0.64 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 3max h MET 89 CO 0.01 0.43 0.17 0.66 1.06 0.00 0.00 176.91 179.24 3max h SER 90 N 0.67 0.00 1.02 1.22 4.64 -1.87 -1.18 113.55 118.05 3max h SER 90 Ca 0.37 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.66 3max h SER 90 Cb 0.39 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 3max h SER 90 CO -0.27 0.00 -1.01 -0.33 -0.87 0.00 0.00 176.83 174.36 3max h GLU 91 N 0.00 0.00 -0.36 4.77 5.08 -1.79 -3.37 114.58 118.92 3max h GLU 91 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3max h GLU 91 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3max h GLU 91 CO -0.00 0.07 0.00 0.66 -1.00 0.00 0.00 179.01 178.73 3max n TYR 92 N -2.76 1.25 -0.29 4.33 4.02 -0.46 -4.78 117.16 118.48 3max n TYR 92 Ca -0.02 -0.82 0.17 0.00 -0.01 0.00 0.00 57.90 57.23 3max n TYR 92 Cb 0.61 -0.36 0.44 0.00 -0.02 0.00 0.00 39.34 40.01 3max n TYR 92 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3max h SER 93 N 2.45 0.55 0.03 7.72 4.64 -1.71 0.10 113.55 127.34 3max h SER 93 Ca 0.00 0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3max h SER 93 Cb 1.57 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.63 3max h SER 93 CO 0.29 0.20 -0.02 0.50 -0.87 0.00 0.00 176.83 176.93 3max h LYS 94 N 0.54 -0.04 -0.77 4.77 1.63 -1.92 -2.96 116.57 117.81 3max h LYS 94 Ca 0.52 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 60.32 3max h LYS 94 Cb 1.12 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.72 3max h LYS 94 CO -0.26 0.45 0.47 1.96 -3.45 0.00 0.00 179.45 178.62 3max h GLN 95 N -0.56 1.04 -0.56 1.90 7.50 -1.63 -0.87 115.11 121.92 3max h GLN 95 Ca -0.00 -0.09 0.03 0.00 0.50 0.00 0.00 58.65 59.08 3max h GLN 95 Cb 0.52 -0.22 -0.04 0.00 0.05 0.00 0.00 27.48 27.79 3max h GLN 95 CO 0.01 0.72 0.34 0.52 -1.50 0.00 0.00 178.83 178.92 3max h MET 96 N 1.06 0.65 -0.26 1.46 2.86 -0.88 -1.52 114.93 118.30 3max h MET 96 Ca 0.28 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.84 3max h MET 96 Cb -0.05 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.45 3max h MET 96 CO -0.05 0.43 0.01 1.96 1.06 0.00 0.00 176.91 180.31 3max h GLN 97 N 0.67 0.45 -0.93 1.72 4.20 -1.20 0.26 115.11 120.28 3max h GLN 97 Ca 0.23 -0.14 0.11 0.00 0.06 0.00 0.00 58.65 58.90 3max h GLN 97 Cb 0.03 -0.04 -0.08 0.00 0.30 0.00 0.00 27.48 27.69 3max h GLN 97 CO -0.10 0.62 0.57 -0.09 -0.67 0.00 0.00 178.83 179.15 3max h ARG 98 N 0.24 0.90 -0.59 1.46 2.43 -0.94 -2.69 114.38 115.20 3max h ARG 98 Ca 0.07 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3max h ARG 98 Cb 0.41 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 3max h ARG 98 CO 0.01 0.59 0.00 1.19 -1.51 0.00 0.00 179.97 180.26 3max n PHE 99 N -4.66 0.77 -3.41 2.20 3.72 -0.59 -4.89 117.46 110.60 3max n PHE 99 Ca 0.16 -0.39 -0.19 0.00 -0.05 0.00 0.00 57.45 56.99 3max n PHE 99 Cb 0.31 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.93 3max n PHE 99 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3max n ASN 100 N 1.60 -3.87 -4.34 4.37 5.15 -0.63 -0.86 115.26 116.67 3max n ASN 100 Ca 0.22 -0.54 -0.31 0.00 -0.60 0.00 0.00 54.58 53.36 3max n ASN 100 Cb 0.62 -4.73 -0.15 0.00 -0.53 0.00 0.00 39.78 34.99 3max n ASN 100 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3max s VAL 101 N -3.32 2.23 0.00 3.44 1.01 -0.02 -4.47 120.40 119.27 3max s VAL 101 Ca 0.25 -1.10 0.00 0.00 0.00 0.00 0.00 61.98 61.13 3max s VAL 101 Cb -0.11 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.47 3max s VAL 101 CO 0.67 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.93 3max n GLY 102 N 2.29 1.44 0.00 4.51 0.00 0.99 -4.37 105.19 110.05 3max n GLY 102 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3max n GLY 102 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3max n GLU 103 N -0.27 0.00 -0.18 1.61 4.07 -1.26 -4.82 120.64 119.79 3max n GLU 103 Ca 0.00 0.00 0.16 0.00 -0.06 0.00 0.00 57.16 57.26 3max n GLU 103 Cb 0.00 0.00 0.49 0.00 -0.06 0.00 0.00 31.44 31.87 3max n GLU 103 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 3max h ASP 104 N 0.00 0.41 -2.99 4.31 5.19 -1.96 -3.27 116.42 118.11 3max h ASP 104 Ca 0.00 0.03 -0.64 0.00 -0.62 0.00 0.00 57.03 55.79 3max h ASP 104 Cb 0.00 -0.06 -0.40 0.00 0.18 0.00 0.00 39.33 39.05 3max h ASP 104 CO 0.00 0.21 -0.42 0.00 -3.12 0.00 0.00 179.24 175.91 3max s PRO 106 N -1.66 1.78 -0.23 0.00 0.04 -1.24 -0.01 135.00 133.69 3max s PRO 106 Ca 0.28 0.22 -0.20 0.00 0.04 0.00 0.00 61.00 61.33 3max s PRO 106 Cb -0.01 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.58 3max s PRO 106 CO -0.13 -1.74 0.62 0.08 0.04 0.00 0.00 177.00 175.87 3max s VAL 107 N -3.45 5.01 0.19 -0.36 1.01 -1.26 -4.68 120.40 116.87 3max s VAL 107 Ca 0.62 1.13 0.03 0.00 0.00 0.00 0.00 61.98 63.77 3max s VAL 107 Cb -0.12 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 3max s VAL 107 CO 0.51 0.08 -0.03 0.72 0.00 0.00 0.00 175.10 176.37 3max s PHE 108 N 2.17 1.40 0.13 5.22 -0.71 -1.26 -4.76 117.98 120.17 3max s PHE 108 Ca 0.27 -0.89 -0.33 0.00 -1.04 0.00 0.00 56.93 54.94 3max s PHE 108 Cb -0.16 -0.78 -0.12 0.00 -1.21 0.00 0.00 43.02 40.75 3max s PHE 108 CO 0.09 -0.04 1.73 -0.25 -1.34 0.00 0.00 175.22 175.42 3max n ASP 109 N -0.32 3.64 -0.08 1.98 8.00 -1.26 -2.02 116.55 126.49 3max n ASP 109 Ca -0.07 1.03 -0.01 0.00 0.71 0.00 0.00 54.79 56.45 3max n ASP 109 Cb 0.63 -1.49 -0.00 0.00 -0.02 0.00 0.00 41.12 40.23 3max n ASP 109 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3max n GLY 110 N 3.93 0.49 0.36 0.44 0.00 -1.26 -4.73 105.19 104.41 3max n GLY 110 Ca 0.18 -0.30 -0.03 0.00 0.00 0.00 0.00 46.02 45.87 3max n GLY 110 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3max h LEU 111 N 0.00 -1.25 -0.59 0.99 5.85 -1.77 -0.04 115.31 118.50 3max h LEU 111 Ca -0.02 0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.93 3max h LEU 111 Cb 0.17 0.64 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 3max h LEU 111 CO 0.03 -0.30 0.25 0.15 -0.34 0.00 0.00 178.44 178.24 3max h PHE 112 N -0.09 0.87 -0.96 1.25 3.57 -1.87 -1.24 116.94 118.47 3max h PHE 112 Ca 0.28 -0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.75 3max h PHE 112 Cb 0.57 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.99 3max h PHE 112 CO -0.73 0.69 0.63 0.93 -2.23 0.00 0.00 178.31 177.60 3max h GLU 113 N 0.81 1.22 -0.55 1.11 5.08 -1.79 0.91 114.58 121.37 3max h GLU 113 Ca 0.20 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.51 3max h GLU 113 Cb 0.17 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 3max h GLU 113 CO -0.02 0.81 0.33 0.35 -1.00 0.00 0.00 179.01 179.48 3max h PHE 114 N 1.26 0.62 -0.75 4.33 3.04 -0.60 0.52 116.94 125.35 3max h PHE 114 Ca 0.37 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.31 3max h PHE 114 Cb -0.08 -0.20 -0.03 0.00 2.56 0.00 0.00 35.95 38.20 3max h PHE 114 CO -0.01 0.35 0.38 0.00 -2.02 0.00 0.00 178.31 177.01 3max h GLN 116 N 1.05 0.96 -0.09 0.00 4.20 -0.32 -1.35 115.11 119.55 3max h GLN 116 Ca 0.26 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 3max h GLN 116 Cb 0.08 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 3max h GLN 116 CO -0.04 0.69 -0.03 -0.07 -0.67 0.00 0.00 178.83 178.71 3max h LEU 117 N 0.95 0.19 -0.68 1.46 3.38 -0.76 0.61 115.31 120.46 3max h LEU 117 Ca 0.25 -0.39 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 3max h LEU 117 Cb -0.01 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3max h LEU 117 CO -0.04 0.54 -0.07 0.77 0.09 0.00 0.00 178.44 179.73 3max h SER 118 N -0.16 0.94 -0.17 -0.43 4.64 -1.42 -3.02 113.55 113.94 3max h SER 118 Ca 0.02 -0.28 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 3max h SER 118 Cb 0.46 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 3max h SER 118 CO 0.01 1.04 0.01 0.74 -0.87 0.00 0.00 176.83 177.76 3max h THR 119 N 0.86 1.24 -1.00 2.95 2.02 -1.26 -3.27 112.91 114.46 3max h THR 119 Ca 0.15 -0.80 0.19 0.00 0.77 0.00 0.00 66.41 66.72 3max h THR 119 Cb 0.60 1.45 -0.10 0.00 -1.74 0.00 0.00 68.15 68.35 3max h THR 119 CO 0.04 0.24 0.61 1.23 0.37 0.00 0.00 175.52 178.01 3max h GLY 120 N 0.05 1.72 1.03 2.16 0.00 -0.78 -1.79 103.07 105.45 3max h GLY 120 Ca 0.05 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 46.99 3max h GLY 120 CO 0.01 -0.06 0.26 -1.33 0.00 0.00 0.00 176.54 175.41 3max h GLY 121 N 0.73 1.12 0.70 4.60 0.00 -1.58 -0.02 103.07 108.62 3max h GLY 121 Ca 0.57 -0.63 -0.06 0.00 0.00 0.00 0.00 47.33 47.21 3max h GLY 121 CO -0.37 0.59 -0.16 1.76 0.00 0.00 0.00 176.54 178.37 3max h SER 122 N 0.99 0.34 -0.46 0.19 0.02 -1.42 -1.49 113.55 111.72 3max h SER 122 Ca 0.23 -0.52 -0.07 0.00 -0.84 0.00 0.00 61.79 60.58 3max h SER 122 Cb 0.24 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 3max h SER 122 CO -0.01 0.79 -0.01 0.58 -1.14 0.00 0.00 176.83 177.04 3max h VAL 123 N -0.11 1.26 -0.65 2.27 2.07 -1.42 -1.11 116.25 118.56 3max h VAL 123 Ca 0.01 -1.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.46 3max h VAL 123 Cb 0.72 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 3max h VAL 123 CO 0.04 0.37 0.37 0.00 0.02 0.00 0.00 177.57 178.36 3max h ALA 124 N 0.91 0.83 -0.62 1.67 0.00 -1.04 -1.81 119.26 119.20 3max h ALA 124 Ca 0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3max h ALA 124 Cb 0.51 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3max h ALA 124 CO 0.02 0.33 0.32 0.78 0.00 0.00 0.00 179.25 180.71 3max h GLY 125 N 0.88 0.95 0.87 0.00 0.00 -1.13 -1.57 103.07 103.07 3max h GLY 125 Ca 0.23 -0.45 0.03 0.00 0.00 0.00 0.00 47.33 47.14 3max h GLY 125 CO -0.04 0.43 0.57 0.00 0.00 0.00 0.00 176.54 177.50 3max h ALA 126 N 1.14 1.16 -0.40 3.60 0.00 -0.90 -1.43 119.26 122.43 3max h ALA 126 Ca 0.22 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 3max h ALA 126 Cb 0.09 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3max h ALA 126 CO -0.03 0.41 0.10 0.28 0.00 0.00 0.00 179.25 180.01 3max h VAL 127 N 1.10 1.23 -0.83 0.00 2.07 -1.11 -0.35 116.25 118.36 3max h VAL 127 Ca 0.35 -0.78 0.03 0.00 0.82 0.00 0.00 66.70 67.12 3max h VAL 127 Cb 0.01 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 3max h VAL 127 CO -0.12 0.27 0.54 0.50 0.02 0.00 0.00 177.57 178.78 3max h LYS 128 N 0.51 1.03 -0.23 1.57 1.63 -0.96 -0.74 116.57 119.38 3max h LYS 128 Ca 0.13 -0.06 -0.04 0.00 -0.85 0.00 0.00 60.65 59.83 3max h LYS 128 Cb 0.31 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 3max h LYS 128 CO 0.00 0.68 -0.02 -0.07 -3.45 0.00 0.00 179.45 176.60 3max h LEU 129 N 1.06 0.41 -0.84 5.20 3.38 -1.13 -1.71 115.31 121.68 3max h LEU 129 Ca 0.32 -0.33 0.10 0.00 0.09 0.00 0.00 57.88 58.07 3max h LEU 129 Cb -0.03 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 40.53 3max h LEU 129 CO -0.10 0.64 0.48 0.78 0.09 0.00 0.00 178.44 180.33 3max h ASN 130 N 0.17 0.69 0.01 -0.43 2.35 -0.61 -0.41 115.58 117.35 3max h ASN 130 Ca 0.06 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 3max h ASN 130 Cb 0.44 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.73 3max h ASN 130 CO 0.01 0.38 0.00 0.54 -1.65 0.00 0.00 177.43 176.72 3max n ARG 131 N -4.74 0.82 -3.31 0.81 1.74 -0.32 -4.89 116.66 106.77 3max n ARG 131 Ca 0.14 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.99 3max n ARG 131 Cb 0.30 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.28 3max n ARG 131 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3max n GLN 132 N -1.01 -5.95 0.00 5.56 6.02 -0.16 -4.89 117.38 116.94 3max n GLN 132 Ca 0.20 0.84 0.10 0.00 -0.01 0.00 0.00 57.00 58.12 3max n GLN 132 Cb 0.09 -5.76 0.08 0.00 1.02 0.00 0.00 30.24 25.67 3max n GLN 132 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 3max n GLN 133 N -4.41 1.76 -3.74 -1.09 6.02 -0.66 -4.95 117.38 110.32 3max n GLN 133 Ca -0.05 -1.67 -0.10 0.00 -0.01 0.00 0.00 57.00 55.17 3max n GLN 133 Cb 0.59 -1.38 -0.05 0.00 1.02 0.00 0.00 30.24 30.41 3max n GLN 133 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 3max s THR 134 N -1.68 0.08 -0.09 5.09 -1.32 -1.24 -5.01 115.64 111.47 3max s THR 134 Ca 0.23 -0.83 0.07 0.00 -1.21 0.00 0.00 61.69 59.95 3max s THR 134 Cb 0.17 -1.34 -0.24 0.00 -1.51 0.00 0.00 72.50 69.58 3max s THR 134 CO 0.26 -0.36 0.49 0.47 -2.21 0.00 0.00 174.62 173.27 3max n ASP 135 N -0.20 1.19 -3.98 8.08 9.92 -0.35 -4.69 116.55 126.52 3max n ASP 135 Ca -0.14 0.30 -0.16 0.00 -0.53 0.00 0.00 54.79 54.26 3max n ASP 135 Cb 0.63 -0.21 -0.14 0.00 -0.64 0.00 0.00 41.12 40.76 3max n ASP 135 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 3max s MET 136 N -2.57 0.48 -0.03 -1.24 -1.94 -0.43 -1.60 119.30 111.97 3max s MET 136 Ca -0.11 -0.27 0.06 0.00 -1.71 0.00 0.00 55.69 53.66 3max s MET 136 Cb 0.07 -0.45 -0.01 0.00 2.01 0.00 0.00 34.83 36.45 3max s MET 136 CO 0.80 0.12 -0.22 0.00 -0.01 0.00 0.00 175.02 175.71 3max s ALA 137 N -0.27 1.82 -0.12 3.03 0.00 -0.43 -1.33 121.76 124.47 3max s ALA 137 Ca 0.01 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.07 3max s ALA 137 Cb -0.03 -0.50 0.01 0.00 0.00 0.00 0.00 23.12 22.60 3max s ALA 137 CO -0.00 0.42 -0.19 0.08 0.00 0.00 0.00 175.76 176.07 3max s VAL 138 N -0.39 1.79 -0.41 0.00 1.01 0.26 -0.67 120.40 121.98 3max s VAL 138 Ca 0.05 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.22 3max s VAL 138 Cb -0.10 -1.60 0.13 0.00 0.00 0.00 0.00 36.38 34.81 3max s VAL 138 CO 0.00 0.50 0.21 0.21 0.00 0.00 0.00 175.10 176.02 3max s ASN 139 N 0.85 3.69 0.49 3.32 2.47 -0.15 -0.52 114.94 125.08 3max s ASN 139 Ca -0.08 -2.42 0.32 0.00 0.42 0.00 0.00 52.86 51.10 3max s ASN 139 Cb -0.15 -0.97 1.30 0.00 -1.45 0.00 0.00 41.25 39.97 3max s ASN 139 CO -0.01 -0.30 1.93 -0.50 -3.72 0.00 0.00 177.10 174.50 3max h TRP 140 N 7.00 0.00 0.00 0.43 -0.00 -1.80 -1.83 115.95 119.74 3max h TRP 140 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.86 3max h TRP 140 Cb 0.95 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.11 3max h TRP 140 CO 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 178.90 3max n ALA 141 N -2.02 2.10 -1.75 1.49 0.00 -1.26 -3.69 120.51 115.39 3max n ALA 141 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3max n ALA 141 Cb 0.29 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.32 3max n ALA 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3max n GLY 142 N 0.97 1.30 1.58 0.00 0.00 -0.72 -4.75 105.19 103.57 3max n GLY 142 Ca 0.05 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.16 3max n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3max n GLY 143 N 5.00 0.71 2.85 -0.02 0.00 -1.26 -2.47 105.19 110.00 3max n GLY 143 Ca 0.00 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 3max n GLY 143 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3max n LEU 144 N -0.06 6.40 0.02 0.99 4.32 -1.26 -4.30 117.00 123.11 3max n LEU 144 Ca 0.00 -3.99 0.10 0.00 -0.02 0.00 0.00 56.01 52.10 3max n LEU 144 Cb 0.41 -1.62 0.41 0.00 -1.62 0.00 0.00 43.42 41.01 3max n LEU 144 CO 0.00 0.86 0.81 0.00 -1.22 0.00 0.00 177.39 177.84 3max n HIS 145 N 6.51 0.13 0.07 -1.77 1.44 -1.26 -3.33 115.22 117.02 3max n HIS 145 Ca 0.51 0.05 0.08 0.00 -2.01 0.00 0.00 57.72 56.35 3max n HIS 145 Cb 0.40 -0.58 -0.04 0.00 0.12 0.00 0.00 29.99 29.89 3max n HIS 145 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 3max n HIS 146 N -1.62 0.89 -1.71 -1.40 8.25 -1.26 -1.27 115.22 117.11 3max n HIS 146 Ca 0.04 0.27 -0.43 0.00 -0.26 0.00 0.00 57.72 57.35 3max n HIS 146 Cb 0.23 -0.96 -0.02 0.00 1.12 0.00 0.00 29.99 30.36 3max n HIS 146 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3max n ALA 147 N -2.25 1.89 -2.37 -1.41 0.00 -1.21 -4.33 120.51 110.83 3max n ALA 147 Ca -0.03 0.38 -0.23 0.00 0.00 0.00 0.00 53.44 53.56 3max n ALA 147 Cb 0.64 -2.37 -0.06 0.00 0.00 0.00 0.00 19.45 17.66 3max n ALA 147 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3max s LYS 148 N -0.67 2.36 0.26 0.00 -0.14 -0.51 -4.57 119.74 116.46 3max s LYS 148 Ca 0.64 -1.69 -0.02 0.00 -1.36 0.00 0.00 55.97 53.54 3max s LYS 148 Cb -0.56 -2.15 0.53 0.00 -1.68 0.00 0.00 37.83 33.98 3max s LYS 148 CO 0.51 -0.11 1.73 -0.22 -0.76 0.00 0.00 175.35 176.49 3max h LYS 149 N 1.30 0.47 -0.18 1.68 3.64 -1.94 -2.97 116.57 118.57 3max h LYS 149 Ca -0.42 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 58.74 3max h LYS 149 Cb 1.26 -0.11 -0.28 0.00 -0.41 0.00 0.00 32.23 32.69 3max h LYS 149 CO 0.65 0.31 -0.86 0.43 -2.27 0.00 0.00 179.45 177.71 3max n SER 150 N -4.98 1.86 -3.63 4.20 7.64 -1.26 -2.24 113.62 115.21 3max n SER 150 Ca 0.17 -2.83 -0.11 0.00 1.01 0.00 0.00 58.87 57.10 3max n SER 150 Cb 0.47 -0.41 -0.07 0.00 -1.01 0.00 0.00 64.21 63.19 3max n SER 150 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3max s GLU 151 N -2.15 0.76 0.60 1.43 2.12 -1.12 -4.61 118.70 115.73 3max s GLU 151 Ca 0.36 1.03 -0.13 0.00 0.36 0.00 0.00 54.97 56.59 3max s GLU 151 Cb 0.37 0.30 -0.04 0.00 0.26 0.00 0.00 34.13 35.03 3max s GLU 151 CO -0.09 -0.11 1.03 0.00 -0.54 0.00 0.00 175.26 175.55 3max s ALA 152 N 0.80 2.93 -0.20 6.30 0.00 -0.04 -1.43 121.76 130.11 3max s ALA 152 Ca -0.03 0.12 -0.27 0.00 0.00 0.00 0.00 51.96 51.78 3max s ALA 152 Cb -0.05 -3.14 0.09 0.00 0.00 0.00 0.00 23.12 20.01 3max s ALA 152 CO -0.07 -0.70 0.80 0.45 0.00 0.00 0.00 175.76 176.24 3max s SER 153 N -3.50 -0.63 -1.42 0.00 0.15 -0.41 -4.67 113.70 103.23 3max s SER 153 Ca 0.58 1.03 -0.00 0.00 0.70 0.00 0.00 55.95 58.27 3max s SER 153 Cb -0.12 0.99 0.00 0.00 -1.71 0.00 0.00 66.02 65.17 3max s SER 153 CO 0.44 -0.34 0.39 0.61 1.20 0.00 0.00 173.24 175.55 3max n GLY 154 N 1.92 -0.21 3.32 9.45 0.00 -1.26 -0.55 105.19 117.85 3max n GLY 154 Ca -0.15 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3max n GLY 154 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3max n PHE 155 N -4.41 0.00 -4.20 1.61 3.72 -1.26 -4.94 117.46 107.98 3max n PHE 155 Ca -0.31 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 56.73 3max n PHE 155 Cb 0.69 -0.30 -0.08 0.00 -0.94 0.00 0.00 39.48 38.84 3max n PHE 155 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3max n TYR 157 N 2.11 0.00 -5.06 0.00 4.02 -1.26 -1.28 117.16 115.68 3max n TYR 157 Ca -0.19 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.40 3max n TYR 157 Cb 0.54 -0.24 -0.17 0.00 -0.02 0.00 0.00 39.34 39.46 3max n TYR 157 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3max s VAL 158 N -2.12 1.82 -1.01 -0.72 1.01 -1.26 -4.63 120.40 113.49 3max s VAL 158 Ca -0.09 -0.89 -0.19 0.00 0.00 0.00 0.00 61.98 60.82 3max s VAL 158 Cb 0.03 -1.58 0.12 0.00 0.00 0.00 0.00 36.38 34.94 3max s VAL 158 CO 0.13 0.51 1.26 0.21 0.00 0.00 0.00 175.10 177.21 3max s ASN 159 N 0.35 6.68 0.49 3.32 3.84 -1.26 -4.74 114.94 123.61 3max s ASN 159 Ca -0.16 -2.10 0.15 0.00 0.21 0.00 0.00 52.86 50.96 3max s ASN 159 Cb -0.17 -2.44 1.14 0.00 -0.55 0.00 0.00 41.25 39.24 3max s ASN 159 CO 0.07 -1.10 2.08 -2.24 -2.79 0.00 0.00 177.10 173.12 3max h ASP 160 N 8.69 0.03 -0.18 -4.21 2.03 -1.93 -2.55 116.42 118.30 3max h ASP 160 Ca 0.20 -0.00 -0.05 0.00 -0.73 0.00 0.00 57.03 56.45 3max h ASP 160 Cb 0.99 -0.01 -0.00 0.00 -0.83 0.00 0.00 39.33 39.48 3max h ASP 160 CO 1.20 0.09 -0.09 0.40 -1.03 0.00 0.00 179.24 179.81 3max h ILE 161 N 0.03 1.31 -0.74 4.15 2.04 -1.87 0.78 117.51 123.20 3max h ILE 161 Ca 0.01 -1.15 -0.06 0.00 1.00 0.00 0.00 64.86 64.66 3max h ILE 161 Cb 0.12 1.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 3max h ILE 161 CO 0.01 0.34 0.23 0.58 0.00 0.00 0.00 178.15 179.32 3max h VAL 162 N 0.06 1.26 -0.40 1.67 2.07 -1.88 -0.67 116.25 118.36 3max h VAL 162 Ca 0.04 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 3max h VAL 162 Cb 0.58 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 3max h VAL 162 CO 0.03 0.36 0.21 -0.07 0.02 0.00 0.00 177.57 178.12 3max h LEU 163 N 1.11 0.50 -0.79 2.57 3.38 -1.35 -0.53 115.31 120.21 3max h LEU 163 Ca 0.24 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 3max h LEU 163 Cb 0.30 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 3max h LEU 163 CO -0.01 0.45 0.27 0.00 0.09 0.00 0.00 178.44 179.25 3max h ALA 164 N 1.07 1.02 -0.46 1.53 0.00 -0.54 -2.09 119.26 119.79 3max h ALA 164 Ca 0.14 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3max h ALA 164 Cb 0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3max h ALA 164 CO -0.02 0.67 0.00 0.82 0.00 0.00 0.00 179.25 180.72 3max h ILE 165 N 1.14 1.26 -0.91 0.00 2.04 -0.95 -0.84 117.51 119.25 3max h ILE 165 Ca 0.25 -1.05 0.07 0.00 1.00 0.00 0.00 64.86 65.14 3max h ILE 165 Cb 0.27 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.31 3max h ILE 165 CO -0.01 0.36 0.59 -0.07 0.00 0.00 0.00 178.15 179.02 3max h LEU 166 N 0.67 0.89 -0.34 1.44 3.38 -0.95 0.41 115.31 120.80 3max h LEU 166 Ca 0.13 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 3max h LEU 166 Cb 0.50 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3max h LEU 166 CO 0.02 0.56 0.12 -0.08 0.09 0.00 0.00 178.44 179.16 3max h GLU 167 N 1.00 0.51 -0.40 1.13 4.57 -0.91 -3.02 114.58 117.47 3max h GLU 167 Ca 0.40 -0.10 -0.05 0.00 -1.18 0.00 0.00 59.36 58.43 3max h GLU 167 Cb 0.25 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 3max h GLU 167 CO -0.16 0.52 0.02 -0.07 -1.18 0.00 0.00 179.01 178.15 3max h LEU 168 N 0.39 0.59 -0.62 1.64 3.38 -0.18 -2.44 115.31 118.07 3max h LEU 168 Ca 0.11 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3max h LEU 168 Cb 0.21 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3max h LEU 168 CO -0.01 0.64 0.00 0.18 0.09 0.00 0.00 178.44 179.35 3max n LEU 169 N -4.27 0.36 0.22 1.67 4.77 0.04 -1.31 117.00 118.48 3max n LEU 169 Ca 0.02 0.62 0.05 0.00 -0.03 0.00 0.00 56.01 56.68 3max n LEU 169 Cb 0.25 -0.62 0.48 0.00 -2.33 0.00 0.00 43.42 41.20 3max n LEU 169 CO 0.40 -0.60 0.85 0.11 -1.33 0.00 0.00 177.39 176.82 3max h LYS 170 N 0.00 0.00 0.00 3.23 1.57 -1.46 -3.33 116.57 116.58 3max h LYS 170 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3max h LYS 170 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3max h LYS 170 CO 0.00 0.24 0.00 0.66 -0.57 0.00 0.00 179.45 179.78 3max n TYR 171 N -4.15 0.00 -4.54 -1.35 4.01 -0.43 -5.03 117.16 105.68 3max n TYR 171 Ca -0.02 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.43 3max n TYR 171 Cb 0.30 0.00 -0.17 0.00 -0.31 0.00 0.00 39.34 39.16 3max n TYR 171 CO 0.00 0.00 0.00 -1.01 -0.46 0.00 0.00 176.86 175.39 3max s HIS 172 N -0.56 2.08 0.16 -0.72 3.76 -0.43 -5.03 115.29 114.55 3max s HIS 172 Ca 0.00 -0.97 -0.10 0.00 -0.15 0.00 0.00 55.06 53.84 3max s HIS 172 Cb 0.00 -1.48 0.01 0.00 1.11 0.00 0.00 32.58 32.22 3max s HIS 172 CO 0.00 -0.48 1.55 0.37 -0.85 0.00 0.00 174.74 175.33 3max h GLN 173 N 7.33 1.01 -4.54 1.40 5.75 -1.88 -3.39 115.11 120.78 3max h GLN 173 Ca -0.30 -0.43 -0.55 0.00 -0.15 0.00 0.00 58.65 57.21 3max h GLN 173 Cb 1.18 -0.04 -0.35 0.00 1.07 0.00 0.00 27.48 29.35 3max h GLN 173 CO 0.50 1.11 -0.82 1.03 -2.65 0.00 0.00 178.83 178.00 3max s ARG 174 N -4.69 1.92 -0.11 1.69 0.52 -1.26 -4.62 118.95 112.40 3max s ARG 174 Ca -0.11 -0.44 0.03 0.00 -0.52 0.00 0.00 55.73 54.68 3max s ARG 174 Cb 0.12 -1.72 -0.00 0.00 0.52 0.00 0.00 34.95 33.87 3max s ARG 174 CO 0.87 -0.12 -0.21 0.08 0.02 0.00 0.00 175.30 175.94 3max s VAL 175 N 1.18 2.35 -0.19 3.52 1.01 0.41 -1.22 120.40 127.46 3max s VAL 175 Ca -0.04 -0.91 -0.09 0.00 0.00 0.00 0.00 61.98 60.94 3max s VAL 175 Cb -0.14 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 3max s VAL 175 CO -0.03 0.55 0.10 -0.22 0.00 0.00 0.00 175.10 175.50 3max s LEU 176 N 0.34 4.02 -0.14 3.92 2.96 -0.18 -2.33 118.68 127.28 3max s LEU 176 Ca -0.17 0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 53.88 3max s LEU 176 Cb -0.17 -2.03 -0.02 0.00 0.50 0.00 0.00 46.19 44.46 3max s LEU 176 CO 0.08 0.17 -0.08 -0.47 -1.32 0.00 0.00 176.35 174.73 3max s TYR 177 N 0.39 2.93 -0.03 5.38 5.04 -0.01 -0.18 117.35 130.86 3max s TYR 177 Ca 0.06 -0.44 0.04 0.00 -2.44 0.00 0.00 57.07 54.29 3max s TYR 177 Cb -0.12 -1.90 -0.00 0.00 0.35 0.00 0.00 41.96 40.29 3max s TYR 177 CO -0.01 -0.10 -0.13 0.42 -1.34 0.00 0.00 175.55 174.40 3max s ILE 178 N 0.31 1.06 -0.18 3.14 1.01 -0.06 -0.34 121.20 126.14 3max s ILE 178 Ca -0.07 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 60.03 3max s ILE 178 Cb -0.15 -0.91 0.06 0.00 0.01 0.00 0.00 42.46 41.47 3max s ILE 178 CO 0.04 0.31 0.03 -0.62 0.00 0.00 0.00 174.94 174.71 3max s ASP 179 N 0.00 2.73 -0.02 3.58 -1.08 -0.42 -0.47 116.67 120.99 3max s ASP 179 Ca -0.01 -0.73 0.12 0.00 -0.52 0.00 0.00 52.55 51.42 3max s ASP 179 Cb -0.08 -0.56 0.37 0.00 -1.46 0.00 0.00 42.92 41.19 3max s ASP 179 CO 0.01 -0.30 1.31 2.30 0.52 0.00 0.00 175.17 179.01 3max n ILE 180 N 5.07 1.16 -1.61 4.11 -5.35 -0.47 -2.51 119.36 119.77 3max n ILE 180 Ca -0.09 -1.10 -0.39 0.00 -0.27 0.00 0.00 62.75 60.90 3max n ILE 180 Cb 0.48 0.41 0.03 0.00 -1.74 0.00 0.00 39.64 38.82 3max n ILE 180 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 3max n ASP 181 N 0.52 0.95 0.29 7.28 2.03 -1.25 -4.61 116.55 121.76 3max n ASP 181 Ca 0.14 0.91 0.18 0.00 0.52 0.00 0.00 54.79 56.53 3max n ASP 181 Cb 0.50 -1.37 0.90 0.00 -0.72 0.00 0.00 41.12 40.43 3max n ASP 181 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 3max h ILE 182 N 0.98 0.23 -3.08 5.18 2.10 -1.81 -3.41 117.51 117.69 3max h ILE 182 Ca -0.47 -0.32 -0.59 0.00 1.08 0.00 0.00 64.86 64.56 3max h ILE 182 Cb 1.35 1.25 -0.04 0.00 -1.09 0.00 0.00 36.82 38.30 3max h ILE 182 CO 0.53 0.04 -0.34 -1.00 -1.08 0.00 0.00 178.15 176.31 3max s HIS 183 N -4.06 3.51 0.27 2.19 3.76 -1.26 -1.15 115.29 118.55 3max s HIS 183 Ca -0.03 0.56 -0.31 0.00 -0.15 0.00 0.00 55.06 55.13 3max s HIS 183 Cb 0.12 -1.99 -0.13 0.00 1.11 0.00 0.00 32.58 31.69 3max s HIS 183 CO 0.51 0.50 1.47 1.58 -0.85 0.00 0.00 174.74 177.95 3max n HIS 184 N 0.42 2.42 -1.91 1.40 -0.00 -1.26 -4.81 115.22 111.47 3max n HIS 184 Ca -0.05 0.38 -0.42 0.00 0.46 0.00 0.00 57.72 58.08 3max n HIS 184 Cb 0.52 -2.51 0.00 0.00 -0.12 0.00 0.00 29.99 27.88 3max n HIS 184 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 3max n GLY 185 N 2.07 4.37 0.26 1.57 0.00 -1.26 -4.77 105.19 107.43 3max n GLY 185 Ca 0.10 -1.68 -0.14 0.00 0.00 0.00 0.00 46.02 44.30 3max n GLY 185 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3max h ASP 186 N 6.05 1.01 -0.70 1.61 -0.00 -1.91 -1.82 116.42 120.66 3max h ASP 186 Ca 0.53 -0.48 -0.02 0.00 -0.00 0.00 0.00 57.03 57.06 3max h ASP 186 Cb 0.65 -0.28 -0.03 0.00 -0.00 0.00 0.00 39.33 39.67 3max h ASP 186 CO 1.81 1.28 0.35 1.23 -0.00 0.00 0.00 179.24 183.92 3max h GLY 187 N 0.75 1.06 0.49 7.15 0.00 -1.37 0.14 103.07 111.28 3max h GLY 187 Ca 0.05 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 3max h GLY 187 CO 0.10 0.48 -0.02 -2.08 0.00 0.00 0.00 176.54 175.02 3max h VAL 188 N 0.96 1.28 -0.58 4.60 2.07 -1.48 -2.17 116.25 120.94 3max h VAL 188 Ca 0.24 -1.15 0.11 0.00 0.82 0.00 0.00 66.70 66.73 3max h VAL 188 Cb 0.09 2.03 -0.09 0.00 -1.52 0.00 0.00 31.29 31.80 3max h VAL 188 CO -0.03 0.29 0.08 -0.08 0.02 0.00 0.00 177.57 177.84 3max h GLU 189 N -0.58 0.19 -0.32 1.57 4.81 -1.27 -2.57 114.58 116.42 3max h GLU 189 Ca -0.01 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 3max h GLU 189 Cb 0.51 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 3max h GLU 189 CO 0.01 0.13 0.10 1.49 -0.73 0.00 0.00 179.01 180.01 3max h GLU 190 N 0.20 0.22 -0.71 1.92 4.81 -0.68 0.12 114.58 120.46 3max h GLU 190 Ca 0.30 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.54 3max h GLU 190 Cb 0.46 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.75 3max h GLU 190 CO -0.42 0.15 0.47 0.00 -0.73 0.00 0.00 179.01 178.47 3max h ALA 191 N 1.21 1.55 -0.21 2.92 0.00 -1.06 -3.13 119.26 120.54 3max h ALA 191 Ca 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3max h ALA 191 Cb 0.12 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3max h ALA 191 CO -0.16 0.40 0.00 1.19 0.00 0.00 0.00 179.25 180.68 3max n PHE 192 N -4.44 0.59 0.27 0.00 3.01 -1.00 -4.73 117.46 111.16 3max n PHE 192 Ca 0.08 -0.79 0.10 0.00 1.01 0.00 0.00 57.45 57.86 3max n PHE 192 Cb 0.08 -0.20 0.72 0.00 -0.01 0.00 0.00 39.48 40.07 3max n PHE 192 CO 0.00 0.00 0.00 -0.92 1.01 0.00 0.00 176.76 176.85 3max h TYR 193 N 1.37 0.00 -0.28 1.38 5.03 -0.71 -2.68 116.97 121.08 3max h TYR 193 Ca 0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 3max h TYR 193 Cb 1.13 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.41 3max h TYR 193 CO 0.31 0.04 0.00 0.25 -1.32 0.00 0.00 178.16 177.44 3max n THR 194 N -4.21 2.02 -4.50 1.81 -2.24 -1.26 -1.99 114.28 103.91 3max n THR 194 Ca -0.03 -1.69 -0.24 0.00 -2.27 0.00 0.00 64.05 59.81 3max n THR 194 Cb 0.12 -0.10 -0.13 0.00 -2.10 0.00 0.00 70.33 68.12 3max n THR 194 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3max s THR 195 N -2.45 1.62 -2.42 4.28 -1.32 -1.01 -3.03 115.64 111.31 3max s THR 195 Ca 0.38 -1.28 0.24 0.00 -1.21 0.00 0.00 61.69 59.82 3max s THR 195 Cb 0.30 -1.43 0.48 0.00 -1.51 0.00 0.00 72.50 70.34 3max s THR 195 CO 0.10 0.10 1.61 -0.90 -2.21 0.00 0.00 174.62 173.32 3max n ASP 196 N 1.62 1.75 0.06 8.08 5.75 -1.24 -4.07 116.55 128.50 3max n ASP 196 Ca -0.18 -1.65 0.13 0.00 -0.01 0.00 0.00 54.79 53.08 3max n ASP 196 Cb 0.54 -0.06 0.44 0.00 -1.03 0.00 0.00 41.12 41.00 3max n ASP 196 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3max n ARG 197 N 0.37 0.16 -3.79 0.11 1.74 -1.26 -4.65 116.66 109.33 3max n ARG 197 Ca 0.17 0.11 -0.22 0.00 -0.77 0.00 0.00 57.85 57.15 3max n ARG 197 Cb 0.37 -1.67 -0.17 0.00 -1.02 0.00 0.00 32.46 29.97 3max n ARG 197 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3max s VAL 198 N -3.07 0.27 -0.18 1.55 1.01 -1.26 -0.45 120.40 118.29 3max s VAL 198 Ca 0.11 0.16 -0.08 0.00 0.00 0.00 0.00 61.98 62.17 3max s VAL 198 Cb 0.15 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 3max s VAL 198 CO 0.60 0.23 0.10 -0.32 0.00 0.00 0.00 175.10 175.71 3max s MET 199 N 1.85 3.95 -0.10 2.72 1.75 -0.99 -4.84 119.30 123.65 3max s MET 199 Ca 0.03 -0.26 0.00 0.00 -1.25 0.00 0.00 55.69 54.21 3max s MET 199 Cb -0.12 -3.29 -0.02 0.00 2.84 0.00 0.00 34.83 34.24 3max s MET 199 CO -0.04 0.39 -0.10 0.95 -0.65 0.00 0.00 175.02 175.56 3max s THR 200 N 0.09 3.35 -0.19 10.11 -4.23 -0.59 -0.83 115.64 123.34 3max s THR 200 Ca 0.08 -0.58 -0.01 0.00 -1.18 0.00 0.00 61.69 59.99 3max s THR 200 Cb -0.12 -2.38 0.05 0.00 1.34 0.00 0.00 72.50 71.39 3max s THR 200 CO -0.00 0.55 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.92 3max s VAL 201 N -0.21 0.99 -0.05 2.29 1.01 0.54 -0.78 120.40 124.20 3max s VAL 201 Ca 0.01 -0.74 0.06 0.00 0.00 0.00 0.00 61.98 61.31 3max s VAL 201 Cb -0.13 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 3max s VAL 201 CO 0.03 -0.05 -0.23 -0.55 0.00 0.00 0.00 175.10 174.30 3max s SER 202 N 1.66 2.75 -0.15 3.32 0.15 -0.55 -1.30 113.70 119.59 3max s SER 202 Ca -0.02 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.19 3max s SER 202 Cb -0.17 -0.67 -0.00 0.00 -1.71 0.00 0.00 66.02 63.47 3max s SER 202 CO -0.07 0.23 -0.15 -0.36 1.20 0.00 0.00 173.24 174.08 3max s PHE 203 N -0.19 2.77 0.14 3.44 0.40 -1.04 -0.04 117.98 123.46 3max s PHE 203 Ca -0.01 -0.99 -0.24 0.00 -0.60 0.00 0.00 56.93 55.09 3max s PHE 203 Cb -0.12 -1.87 0.07 0.00 0.51 0.00 0.00 43.02 41.61 3max s PHE 203 CO 0.02 -0.44 0.63 -3.38 0.70 0.00 0.00 175.22 172.75 3max s HIS 204 N 0.74 -0.53 0.29 0.36 -3.43 -0.97 -4.51 115.29 107.24 3max s HIS 204 Ca -0.07 0.34 -0.29 0.00 -0.80 0.00 0.00 55.06 54.24 3max s HIS 204 Cb -0.15 0.55 -0.10 0.00 -1.43 0.00 0.00 32.58 31.45 3max s HIS 204 CO 0.01 -0.82 1.19 0.21 -2.00 0.00 0.00 174.74 173.34 3max s LYS 205 N -3.63 4.51 -0.01 -0.38 2.20 -0.30 -0.02 119.74 122.12 3max s LYS 205 Ca 0.01 1.97 -0.00 0.00 -0.36 0.00 0.00 55.97 57.59 3max s LYS 205 Cb -0.01 -3.15 0.02 0.00 -1.51 0.00 0.00 37.83 33.18 3max s LYS 205 CO -0.12 0.02 0.02 -0.47 -0.36 0.00 0.00 175.35 174.44 3max s TYR 206 N -1.00 0.01 0.00 4.03 6.14 -0.38 -4.65 117.35 121.49 3max s TYR 206 Ca 0.47 0.08 0.00 0.00 0.64 0.00 0.00 57.07 58.27 3max s TYR 206 Cb -0.35 -0.13 0.00 0.00 0.42 0.00 0.00 41.96 41.90 3max s TYR 206 CO 0.45 -0.05 0.00 0.41 0.64 0.00 0.00 175.55 177.00 3max n GLY 207 N 3.68 2.53 3.94 8.97 0.00 -1.26 -4.69 105.19 118.35 3max n GLY 207 Ca -0.21 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 44.70 3max n GLY 207 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3max n GLU 208 N 0.00 -0.80 -3.72 1.61 0.28 -1.26 -4.97 120.64 111.78 3max n GLU 208 Ca 0.00 0.23 -0.14 0.00 -0.16 0.00 0.00 57.16 57.10 3max n GLU 208 Cb 0.00 -3.27 -0.09 0.00 1.43 0.00 0.00 31.44 29.51 3max n GLU 208 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 3max s TYR 209 N -3.57 -0.37 0.38 -1.84 6.14 -1.26 -5.08 117.35 111.75 3max s TYR 209 Ca 0.44 0.79 -0.28 0.00 0.64 0.00 0.00 57.07 58.66 3max s TYR 209 Cb -0.21 0.16 -0.10 0.00 0.42 0.00 0.00 41.96 42.22 3max s TYR 209 CO 0.93 -0.32 1.46 0.12 0.64 0.00 0.00 175.55 178.38 3max s PHE 210 N -0.50 2.62 -2.43 4.97 2.19 -1.26 -0.60 117.98 122.97 3max s PHE 210 Ca -0.06 1.21 0.27 0.00 0.33 0.00 0.00 56.93 58.68 3max s PHE 210 Cb -0.04 -3.97 1.05 0.00 -1.31 0.00 0.00 43.02 38.76 3max s PHE 210 CO 0.03 -2.85 1.74 -0.35 1.83 0.00 0.00 175.22 175.62 3max n PRO 211 N 0.40 1.63 -0.06 10.12 -0.04 -1.26 -4.46 135.00 141.33 3max n PRO 211 Ca 0.01 -0.92 0.00 0.00 -0.04 0.00 0.00 63.50 62.55 3max n PRO 211 Cb 0.40 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 3max n PRO 211 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3max n GLY 212 N 1.16 0.46 2.40 0.55 0.00 0.23 -5.07 105.19 104.91 3max n GLY 212 Ca 0.19 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.06 3max n GLY 212 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3max n THR 213 N -2.00 0.00 -1.81 2.61 -2.24 -1.26 -4.87 114.28 104.71 3max n THR 213 Ca 0.00 -1.30 0.00 0.00 -2.27 0.00 0.00 64.05 60.48 3max n THR 213 Cb 0.00 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 3max n THR 213 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3max n GLY 214 N 0.76 0.82 3.75 3.38 0.00 -1.26 -4.80 105.19 107.84 3max n GLY 214 Ca 0.03 -0.64 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 3max n GLY 214 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3max s ASP 215 N -2.81 5.43 0.39 1.61 -1.08 -1.26 -4.40 116.67 114.55 3max s ASP 215 Ca 0.00 2.53 0.28 0.00 -0.52 0.00 0.00 52.55 54.84 3max s ASP 215 Cb 0.00 -2.62 1.25 0.00 -1.46 0.00 0.00 42.92 40.10 3max s ASP 215 CO 0.00 -1.44 1.85 0.17 0.52 0.00 0.00 175.17 176.26 3max h LEU 216 N 1.37 0.00 0.00 -1.34 -0.00 -1.98 -1.08 115.31 112.28 3max h LEU 216 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.38 3max h LEU 216 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.95 3max h LEU 216 CO 0.57 0.00 0.00 0.54 -0.00 0.00 0.00 178.44 179.55 3max n ARG 217 N -2.58 0.67 -2.88 0.17 1.74 -1.26 -4.62 116.66 107.90 3max n ARG 217 Ca 0.01 0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.67 3max n ARG 217 Cb 0.21 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.11 3max n ARG 217 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3max s ASP 218 N -2.29 6.31 0.00 0.55 -0.00 -0.41 -4.85 116.67 115.97 3max s ASP 218 Ca 0.36 -0.49 0.00 0.00 -0.00 0.00 0.00 52.55 52.42 3max s ASP 218 Cb 0.20 -2.41 0.00 0.00 -0.00 0.00 0.00 42.92 40.71 3max s ASP 218 CO 0.39 -1.20 0.55 2.30 -0.00 0.00 0.00 175.17 177.21 3max n ILE 219 N 6.09 0.16 0.00 0.77 -5.35 -1.26 -4.43 119.36 115.34 3max n ILE 219 Ca 0.00 -0.55 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 3max n ILE 219 Cb 0.47 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.35 3max n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3max n GLY 220 N -0.08 1.51 3.13 3.28 0.00 -1.26 0.39 105.19 112.16 3max n GLY 220 Ca 0.00 -2.09 -0.09 0.00 0.00 0.00 0.00 46.02 43.84 3max n GLY 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3max s ALA 221 N -1.78 -0.08 0.00 4.61 0.00 -0.84 -4.30 121.76 119.37 3max s ALA 221 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.40 3max s ALA 221 Cb 0.00 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.39 3max s ALA 221 CO 0.00 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.83 3max n GLY 222 N 0.66 3.16 0.33 0.00 0.00 -1.26 -0.63 105.19 107.46 3max n GLY 222 Ca -0.18 -0.19 0.17 0.00 0.00 0.00 0.00 46.02 45.82 3max n GLY 222 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3max h LYS 223 N 0.00 0.00 -0.17 1.61 1.57 -1.93 -1.96 116.57 115.69 3max h LYS 223 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3max h LYS 223 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3max h LYS 223 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 3max n GLY 224 N -1.45 0.31 3.70 3.86 0.00 0.20 -3.69 105.19 108.13 3max n GLY 224 Ca 0.02 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 3max n GLY 224 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3max s LYS 225 N -1.79 4.16 0.00 1.61 2.20 -0.74 -0.64 119.74 124.54 3max s LYS 225 Ca 0.32 2.51 0.00 0.00 -0.36 0.00 0.00 55.97 58.44 3max s LYS 225 Cb 0.17 -3.40 0.00 0.00 -1.51 0.00 0.00 37.83 33.09 3max s LYS 225 CO 0.26 -0.76 0.00 0.66 -0.36 0.00 0.00 175.35 175.15 3max n TYR 226 N 4.99 0.00 -0.50 4.03 4.01 0.16 -4.89 117.16 124.97 3max n TYR 226 Ca 0.16 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 58.00 3max n TYR 226 Cb 0.38 0.00 0.32 0.00 -0.31 0.00 0.00 39.34 39.73 3max n TYR 226 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3max n TYR 227 N -2.00 1.18 -4.88 -0.72 4.02 0.19 -4.82 117.16 110.12 3max n TYR 227 Ca 0.00 -0.57 -0.29 0.00 -0.01 0.00 0.00 57.90 57.03 3max n TYR 227 Cb 0.00 -0.13 -0.17 0.00 -0.02 0.00 0.00 39.34 39.02 3max n TYR 227 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3max s ALA 228 N -1.48 1.78 -0.09 -0.72 0.00 -0.99 -1.54 121.76 118.73 3max s ALA 228 Ca 0.48 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.71 3max s ALA 228 Cb 0.28 -0.73 0.02 0.00 0.00 0.00 0.00 23.12 22.69 3max s ALA 228 CO 0.27 0.17 -0.12 0.08 0.00 0.00 0.00 175.76 176.16 3max s VAL 229 N 0.55 1.23 -0.07 0.00 1.01 0.04 -4.24 120.40 118.92 3max s VAL 229 Ca -0.16 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.36 3max s VAL 229 Cb -0.17 -1.15 0.01 0.00 0.00 0.00 0.00 36.38 35.07 3max s VAL 229 CO 0.05 0.39 -0.14 0.20 0.00 0.00 0.00 175.10 175.60 3max s ASN 230 N 1.03 1.95 -0.51 3.32 0.01 -1.26 -1.48 114.94 118.01 3max s ASN 230 Ca -0.07 -0.33 -0.02 0.00 -0.71 0.00 0.00 52.86 51.73 3max s ASN 230 Cb -0.15 -0.89 0.13 0.00 0.41 0.00 0.00 41.25 40.75 3max s ASN 230 CO -0.01 0.05 0.30 0.12 -1.51 0.00 0.00 177.10 176.05 3max s PHE 231 N 0.60 3.49 0.20 2.20 5.99 0.94 -4.35 117.98 127.05 3max s PHE 231 Ca -0.15 -2.67 -0.30 0.00 0.00 0.00 0.00 56.93 53.82 3max s PHE 231 Cb -0.16 -3.15 -0.08 0.00 0.00 0.00 0.00 43.02 39.63 3max s PHE 231 CO 0.04 -0.89 1.09 -1.25 -0.00 0.00 0.00 175.22 174.21 3max s PRO 232 N 0.47 4.62 0.18 10.12 0.04 -1.26 -2.28 135.00 146.88 3max s PRO 232 Ca 0.13 1.72 0.05 0.00 0.04 0.00 0.00 61.00 62.94 3max s PRO 232 Cb -0.22 -3.26 -0.05 0.00 0.04 0.00 0.00 34.50 31.01 3max s PRO 232 CO -0.04 0.13 -0.09 -1.64 0.04 0.00 0.00 177.00 175.40 3max s MET 233 N -0.63 1.19 0.48 4.56 -1.94 0.97 -4.89 119.30 119.04 3max s MET 233 Ca 0.48 -1.54 0.08 0.00 -1.71 0.00 0.00 55.69 53.01 3max s MET 233 Cb -0.30 -0.75 0.04 0.00 2.01 0.00 0.00 34.83 35.83 3max s MET 233 CO 0.36 0.07 0.63 1.03 -0.01 0.00 0.00 175.02 177.09 3max s ARG 234 N -3.75 2.60 0.47 2.03 1.81 -1.26 -1.25 118.95 119.60 3max s ARG 234 Ca 0.21 -1.43 -0.21 0.00 -1.72 0.00 0.00 55.73 52.57 3max s ARG 234 Cb 0.02 -2.66 -0.11 0.00 -0.45 0.00 0.00 34.95 31.75 3max s ARG 234 CO 0.04 -0.48 0.66 -0.25 -0.68 0.00 0.00 175.30 174.58 3max n ASP 235 N -1.96 -0.40 0.00 0.23 9.92 -1.26 -3.86 116.55 119.22 3max n ASP 235 Ca 0.10 0.89 0.00 0.00 -0.53 0.00 0.00 54.79 55.25 3max n ASP 235 Cb 0.60 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.89 3max n ASP 235 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3max n GLY 236 N 1.64 0.63 3.70 0.44 0.00 0.92 -1.65 105.19 110.87 3max n GLY 236 Ca 0.11 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3max n GLY 236 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3max n ILE 237 N -2.73 2.45 -4.53 -0.61 3.06 -1.25 -4.05 119.36 111.70 3max n ILE 237 Ca 0.00 -0.50 -0.30 0.00 -2.50 0.00 0.00 62.75 59.45 3max n ILE 237 Cb 0.00 -1.55 -0.08 0.00 0.54 0.00 0.00 39.64 38.56 3max n ILE 237 CO 0.00 0.00 0.00 1.51 -2.50 0.00 0.00 176.55 175.56 3max s ASP 238 N -0.50 4.17 0.22 9.51 1.47 -1.26 -0.25 116.67 130.02 3max s ASP 238 Ca 0.60 -1.44 -0.07 0.00 1.18 0.00 0.00 52.55 52.82 3max s ASP 238 Cb -0.52 0.11 0.33 0.00 -0.34 0.00 0.00 42.92 42.50 3max s ASP 238 CO 0.59 -0.73 1.77 0.44 0.68 0.00 0.00 175.17 177.92 3max h ASP 239 N 1.40 0.44 -0.34 2.11 3.32 -1.95 -1.45 116.42 119.96 3max h ASP 239 Ca -0.43 0.06 -0.06 0.00 0.02 0.00 0.00 57.03 56.62 3max h ASP 239 Cb 1.28 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.81 3max h ASP 239 CO 0.73 0.25 -0.02 -0.33 -1.72 0.00 0.00 179.24 178.16 3max h GLU 240 N 0.58 0.61 -0.64 3.56 5.08 -1.96 0.20 114.58 122.02 3max h GLU 240 Ca 0.35 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3max h GLU 240 Cb 0.37 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 3max h GLU 240 CO -0.27 0.75 0.35 0.77 -1.00 0.00 0.00 179.01 179.60 3max h SER 241 N 0.41 0.80 -0.21 1.42 0.02 -1.91 -1.89 113.55 112.20 3max h SER 241 Ca 0.09 -0.10 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 3max h SER 241 Cb 0.48 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.81 3max h SER 241 CO 0.02 0.66 -0.23 0.22 -1.14 0.00 0.00 176.83 176.37 3max h TYR 242 N 0.87 0.63 -0.03 3.45 3.20 -1.16 -3.01 116.97 120.91 3max h TYR 242 Ca 0.22 -0.19 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 3max h TYR 242 Cb 0.05 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 3max h TYR 242 CO -0.01 0.88 -0.14 0.78 -1.64 0.00 0.00 178.16 178.03 3max h GLY 243 N 0.20 0.04 2.00 1.82 0.00 -0.89 0.19 103.07 106.43 3max h GLY 243 Ca 0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 3max h GLY 243 CO 0.06 0.02 -0.09 0.06 0.00 0.00 0.00 176.54 176.59 3max h GLN 244 N 0.04 0.00 0.00 4.80 3.07 -1.20 -3.33 115.11 118.49 3max h GLN 244 Ca 0.01 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.63 3max h GLN 244 Cb 0.28 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.82 3max h GLN 244 CO 0.02 0.09 -1.44 -0.89 0.09 0.00 0.00 178.83 176.69 3max n ILE 245 N -3.46 0.44 0.17 1.86 -0.00 -0.78 -4.61 119.36 112.98 3max n ILE 245 Ca -0.02 -0.24 -0.13 0.00 -0.00 0.00 0.00 62.75 62.37 3max n ILE 245 Cb 0.23 -0.82 -0.08 0.00 -0.00 0.00 0.00 39.64 38.98 3max n ILE 245 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.55 176.70 3max h PHE 246 N 0.00 -0.43 -0.13 1.39 3.04 -1.09 -2.25 116.94 117.47 3max h PHE 246 Ca -0.17 -0.01 0.02 0.00 3.98 0.00 0.00 57.97 61.79 3max h PHE 246 Cb 1.35 0.14 -0.02 0.00 2.56 0.00 0.00 35.95 39.98 3max h PHE 246 CO 0.00 -0.09 0.00 -0.22 -2.02 0.00 0.00 178.31 175.99 3max h LYS 247 N -0.85 0.05 -0.79 1.11 3.64 -1.83 -0.08 116.57 117.82 3max h LYS 247 Ca -0.05 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.39 3max h LYS 247 Cb 0.53 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.28 3max h LYS 247 CO 0.08 0.03 0.47 -1.35 -2.27 0.00 0.00 179.45 176.42 3max h PRO 248 N 0.05 0.84 -0.13 1.90 0.11 -1.81 0.13 132.00 133.09 3max h PRO 248 Ca 0.06 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 3max h PRO 248 Cb 0.07 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 3max h PRO 248 CO -0.10 0.56 0.02 0.82 -0.21 0.00 0.00 178.00 179.09 3max h ILE 249 N 0.87 1.21 -0.64 4.15 1.08 -1.16 -2.04 117.51 120.98 3max h ILE 249 Ca 0.35 -0.67 -0.09 0.00 -0.39 0.00 0.00 64.86 64.05 3max h ILE 249 Cb 0.18 1.41 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 3max h ILE 249 CO -0.18 0.20 0.06 0.40 -0.69 0.00 0.00 178.15 177.94 3max h ILE 250 N 0.00 1.27 -0.75 -0.67 1.08 -0.81 -0.64 117.51 116.99 3max h ILE 250 Ca 0.04 -1.10 0.01 0.00 -0.39 0.00 0.00 64.86 63.42 3max h ILE 250 Cb 0.28 0.71 -0.04 0.00 -3.07 0.00 0.00 36.82 34.71 3max h ILE 250 CO 0.00 0.41 0.50 0.28 -0.69 0.00 0.00 178.15 178.65 3max h SER 251 N 1.01 0.86 -0.37 1.72 0.02 -0.72 0.90 113.55 116.97 3max h SER 251 Ca 0.19 -0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 61.02 3max h SER 251 Cb 0.50 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 3max h SER 251 CO 0.02 0.63 -0.14 0.50 -1.14 0.00 0.00 176.83 176.70 3max h LYS 252 N 1.02 0.74 -0.33 3.45 1.63 -1.09 -1.55 116.57 120.44 3max h LYS 252 Ca 0.28 -0.31 0.04 0.00 -0.85 0.00 0.00 60.65 59.81 3max h LYS 252 Cb -0.12 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 31.44 3max h LYS 252 CO -0.06 0.91 0.08 0.28 -3.45 0.00 0.00 179.45 177.22 3max h VAL 253 N 0.54 0.86 -0.94 2.00 2.07 -0.86 -1.16 116.25 118.76 3max h VAL 253 Ca 0.09 -0.07 0.03 0.00 0.82 0.00 0.00 66.70 67.57 3max h VAL 253 Cb 0.67 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3max h VAL 253 CO 0.05 0.04 0.62 0.24 0.02 0.00 0.00 177.57 178.53 3max h MET 254 N 0.21 1.17 -0.25 1.57 2.86 -0.63 0.14 114.93 120.00 3max h MET 254 Ca 0.15 -0.07 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 3max h MET 254 Cb 0.15 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 3max h MET 254 CO -0.19 0.77 0.00 1.49 1.06 0.00 0.00 176.91 180.05 3max h GLU 255 N 1.21 0.45 0.17 1.72 4.81 -0.84 -1.08 114.58 121.00 3max h GLU 255 Ca 0.37 -0.14 -0.23 0.00 -0.13 0.00 0.00 59.36 59.22 3max h GLU 255 Cb -0.03 -0.04 0.02 0.00 0.63 0.00 0.00 28.75 29.33 3max h GLU 255 CO -0.11 0.62 -1.05 0.52 -0.73 0.00 0.00 179.01 178.25 3max h MET 256 N 0.23 0.35 0.07 1.92 2.86 -1.09 -3.39 114.93 115.88 3max h MET 256 Ca 0.07 -0.60 -0.30 0.00 -2.06 0.00 0.00 59.70 56.81 3max h MET 256 Cb 0.41 0.22 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 3max h MET 256 CO 0.01 1.29 -1.62 -0.92 1.06 0.00 0.00 176.91 176.73 3max h TYR 257 N -0.24 0.26 -6.35 -0.22 -0.00 -0.82 -3.49 116.97 106.10 3max h TYR 257 Ca -0.19 -0.19 -0.46 0.00 -0.00 0.00 0.00 58.73 57.89 3max h TYR 257 Cb 1.78 -0.01 0.05 0.00 -0.00 0.00 0.00 36.73 38.56 3max h TYR 257 CO 0.17 1.28 -0.94 1.04 -0.00 0.00 0.00 178.16 179.71 3max n GLN 258 N -3.31 -1.41 -1.44 1.82 6.02 -0.41 -4.94 117.38 113.71 3max n GLN 258 Ca -0.18 0.40 -0.31 0.00 -0.01 0.00 0.00 57.00 56.90 3max n GLN 258 Cb 1.04 -3.98 0.07 0.00 1.02 0.00 0.00 30.24 28.39 3max n GLN 258 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3max s PRO 259 N -6.25 2.53 0.00 -1.09 0.04 -1.26 -4.88 135.00 124.10 3max s PRO 259 Ca 0.41 1.17 0.16 0.00 0.04 0.00 0.00 61.00 62.78 3max s PRO 259 Cb -0.16 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 3max s PRO 259 CO 0.88 -1.43 0.78 -1.13 0.04 0.00 0.00 177.00 176.14 3max n SER 260 N -3.18 1.22 -3.84 6.66 3.41 -0.35 -4.98 113.62 112.55 3max n SER 260 Ca 0.09 -1.11 -0.10 0.00 -0.26 0.00 0.00 58.87 57.49 3max n SER 260 Cb 0.53 0.73 -0.08 0.00 -0.26 0.00 0.00 64.21 65.13 3max n SER 260 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3max s ALA 261 N -2.22 -0.35 -0.02 7.33 0.00 -1.22 -4.26 121.76 121.02 3max s ALA 261 Ca 0.10 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 51.75 3max s ALA 261 Cb 0.13 0.31 0.01 0.00 0.00 0.00 0.00 23.12 23.57 3max s ALA 261 CO 0.54 -0.39 -0.04 0.08 0.00 0.00 0.00 175.76 175.95 3max s VAL 262 N -2.76 0.40 -0.17 0.00 1.01 -0.45 -1.01 120.40 117.43 3max s VAL 262 Ca -0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 61.98 61.79 3max s VAL 262 Cb -0.00 -0.39 -0.00 0.00 0.00 0.00 0.00 36.38 35.99 3max s VAL 262 CO -0.05 0.15 -0.14 -0.69 0.00 0.00 0.00 175.10 174.37 3max s VAL 263 N 0.30 2.74 -0.26 2.92 1.01 0.75 -1.05 120.40 126.81 3max s VAL 263 Ca -0.03 -0.73 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 3max s VAL 263 Cb -0.07 -2.17 0.03 0.00 0.00 0.00 0.00 36.38 34.16 3max s VAL 263 CO -0.00 0.50 -0.04 -0.22 0.00 0.00 0.00 175.10 175.33 3max s LEU 264 N 0.99 3.33 -0.22 3.92 2.96 0.48 -0.88 118.68 129.25 3max s LEU 264 Ca -0.02 -0.92 -0.21 0.00 -0.22 0.00 0.00 54.13 52.76 3max s LEU 264 Cb -0.15 -1.68 -0.02 0.00 0.50 0.00 0.00 46.19 44.84 3max s LEU 264 CO -0.02 -0.15 0.65 -1.58 -1.32 0.00 0.00 176.35 173.92 3max s GLN 265 N 1.32 4.17 -0.57 1.98 -0.44 0.38 -0.80 119.66 125.71 3max s GLN 265 Ca -0.01 0.62 0.02 0.00 -2.50 0.00 0.00 55.36 53.49 3max s GLN 265 Cb -0.17 -3.61 0.43 0.00 -1.64 0.00 0.00 33.01 28.01 3max s GLN 265 CO -0.04 -0.33 1.65 0.00 0.50 0.00 0.00 175.29 177.07 3max n GLY 267 N -0.70 0.89 0.89 0.00 0.00 -1.23 -4.63 105.19 100.40 3max n GLY 267 Ca 0.52 0.74 0.07 0.00 0.00 0.00 0.00 46.02 47.35 3max n GLY 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3max n ALA 268 N 3.81 2.51 1.90 4.61 0.00 0.64 -3.77 120.51 130.21 3max n ALA 268 Ca 0.20 -0.84 0.16 0.00 0.00 0.00 0.00 53.44 52.96 3max n ALA 268 Cb 0.23 -0.97 0.88 0.00 0.00 0.00 0.00 19.45 19.59 3max n ALA 268 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3max n ASP 269 N 0.80 0.19 -0.34 0.00 5.68 -1.20 -2.57 116.55 119.10 3max n ASP 269 Ca 0.15 -1.02 0.10 0.00 -0.50 0.00 0.00 54.79 53.53 3max n ASP 269 Cb 0.43 -0.01 0.46 0.00 -1.14 0.00 0.00 41.12 40.85 3max n ASP 269 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3max n SER 270 N -0.87 1.02 -4.85 -1.12 3.41 -1.26 -4.20 113.62 105.76 3max n SER 270 Ca 0.23 -1.58 -0.33 0.00 -0.26 0.00 0.00 58.87 56.93 3max n SER 270 Cb 0.15 -0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 63.98 3max n SER 270 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3max s LEU 271 N -1.60 4.11 0.14 1.04 1.43 -1.06 -3.44 118.68 119.30 3max s LEU 271 Ca 0.31 1.28 -0.34 0.00 -1.03 0.00 0.00 54.13 54.35 3max s LEU 271 Cb 0.16 -3.99 -0.16 0.00 0.03 0.00 0.00 46.19 42.22 3max s LEU 271 CO 0.25 -0.17 1.13 -0.24 0.23 0.00 0.00 176.35 177.56 3max n SER 272 N -0.20 1.07 0.00 2.29 2.88 0.49 -2.30 113.62 117.85 3max n SER 272 Ca 0.03 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 3max n SER 272 Cb 0.53 -1.16 0.00 0.00 -0.75 0.00 0.00 64.21 62.82 3max n SER 272 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3max n GLY 273 N 2.02 0.57 3.77 0.46 0.00 -1.26 -4.94 105.19 105.81 3max n GLY 273 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3max n GLY 273 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3max s ASP 274 N -2.07 6.39 0.38 1.61 2.15 -0.97 -4.74 116.67 119.42 3max s ASP 274 Ca 0.00 2.74 0.05 0.00 0.43 0.00 0.00 52.55 55.77 3max s ASP 274 Cb 0.00 -2.65 0.76 0.00 -0.30 0.00 0.00 42.92 40.73 3max s ASP 274 CO 0.00 -0.80 2.02 -0.09 -0.17 0.00 0.00 175.17 176.13 3max h ARG 275 N 2.87 0.69 0.00 4.34 2.43 -1.93 -3.25 114.38 119.53 3max h ARG 275 Ca -0.50 -0.04 -0.22 0.00 -0.81 0.00 0.00 59.98 58.41 3max h ARG 275 Cb 1.24 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 30.60 3max h ARG 275 CO 0.63 0.46 -1.82 1.28 -1.51 0.00 0.00 179.97 179.01 3max n LEU 276 N -4.46 0.42 -4.90 3.80 4.77 -1.26 -5.04 117.00 110.33 3max n LEU 276 Ca 0.06 -0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.74 3max n LEU 276 Cb 0.09 0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.42 3max n LEU 276 CO 0.35 0.36 0.70 -0.83 -1.33 0.00 0.00 177.39 176.64 3max s GLY 277 N -4.60 1.62 -0.07 -0.72 0.00 -1.23 -5.03 107.32 97.29 3max s GLY 277 Ca -0.08 -0.52 0.14 0.00 0.00 0.00 0.00 44.72 44.26 3max s GLY 277 CO 0.47 -0.15 1.13 0.00 0.00 0.00 0.00 173.10 174.55 3max s PHE 279 N -1.32 2.59 -0.23 0.00 2.99 -1.26 -0.05 117.98 120.70 3max s PHE 279 Ca 0.24 0.01 0.16 0.00 0.00 0.00 0.00 56.93 57.34 3max s PHE 279 Cb 0.25 -2.89 0.47 0.00 0.00 0.00 0.00 43.02 40.85 3max s PHE 279 CO -0.05 -1.15 1.16 -1.71 -0.00 0.00 0.00 175.22 173.46 3max n ASN 280 N -2.55 2.80 -4.80 1.36 5.15 0.65 -3.75 115.26 114.11 3max n ASN 280 Ca 0.09 -2.92 -0.35 0.00 -0.60 0.00 0.00 54.58 50.80 3max n ASN 280 Cb 0.60 -0.41 -0.07 0.00 -0.53 0.00 0.00 39.78 39.37 3max n ASN 280 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3max s LEU 281 N -3.18 4.16 0.68 1.20 1.43 -1.22 -4.30 118.68 117.44 3max s LEU 281 Ca 0.38 1.71 -0.02 0.00 -1.03 0.00 0.00 54.13 55.18 3max s LEU 281 Cb 0.37 -4.20 0.09 0.00 0.03 0.00 0.00 46.19 42.48 3max s LEU 281 CO -0.03 -0.19 0.94 0.42 0.23 0.00 0.00 176.35 177.73 3max s THR 282 N -1.86 2.32 0.29 5.49 -4.23 -1.26 -0.38 115.64 116.01 3max s THR 282 Ca 0.55 -0.53 -0.01 0.00 -1.18 0.00 0.00 61.69 60.51 3max s THR 282 Cb -0.14 -2.78 0.19 0.00 1.34 0.00 0.00 72.50 71.11 3max s THR 282 CO 0.19 0.00 1.88 0.58 -0.54 0.00 0.00 174.62 176.72 3max h VAL 283 N -0.41 1.22 -0.48 2.29 2.07 -1.94 -1.53 116.25 117.46 3max h VAL 283 Ca -0.40 -0.66 -0.06 0.00 0.82 0.00 0.00 66.70 66.41 3max h VAL 283 Cb 1.28 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 3max h VAL 283 CO 0.47 0.27 0.07 0.11 0.02 0.00 0.00 177.57 178.51 3max h LYS 284 N 0.90 0.80 -0.85 1.57 1.57 -1.94 0.10 116.57 118.73 3max h LYS 284 Ca 0.22 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3max h LYS 284 Cb 0.15 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.33 3max h LYS 284 CO -0.02 0.81 0.44 0.78 -0.57 0.00 0.00 179.45 180.89 3max h GLY 285 N 0.67 1.29 0.63 3.86 0.00 -1.87 -0.72 103.07 106.93 3max h GLY 285 Ca 0.15 -0.61 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 3max h GLY 285 CO 0.01 0.58 -0.00 0.84 0.00 0.00 0.00 176.54 177.97 3max h HIS 286 N 1.20 0.01 -0.01 5.60 -0.00 -1.14 -3.14 115.15 117.67 3max h HIS 286 Ca 0.30 -0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.65 3max h HIS 286 Cb 0.06 -0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.47 3max h HIS 286 CO 0.01 0.38 -0.07 0.00 -0.00 0.00 0.00 177.93 178.25 3max h ALA 287 N 0.63 1.87 -0.90 5.26 0.00 -0.70 -1.48 119.26 123.94 3max h ALA 287 Ca 0.00 -0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.05 3max h ALA 287 Cb 0.38 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 3max h ALA 287 CO 0.00 0.10 0.60 -0.22 0.00 0.00 0.00 179.25 179.73 3max h LYS 288 N 0.01 0.34 -0.64 0.00 1.63 -1.07 0.00 116.57 116.84 3max h LYS 288 Ca 0.00 -0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 59.72 3max h LYS 288 Cb 0.13 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.66 3max h LYS 288 CO 0.01 0.22 0.16 0.00 -3.45 0.00 0.00 179.45 176.40 3max h VAL 290 N 0.96 1.25 -0.42 0.00 2.07 -1.14 -2.19 116.25 116.78 3max h VAL 290 Ca 0.21 -0.86 0.08 0.00 0.82 0.00 0.00 66.70 66.94 3max h VAL 290 Cb 0.33 1.41 -0.07 0.00 -1.52 0.00 0.00 31.29 31.44 3max h VAL 290 CO -0.00 0.26 -0.01 -0.33 0.02 0.00 0.00 177.57 177.51 3max h GLU 291 N 0.13 0.09 0.14 1.57 5.08 -1.08 -0.46 114.58 120.05 3max h GLU 291 Ca 0.06 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3max h GLU 291 Cb 0.39 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3max h GLU 291 CO 0.01 0.06 -0.14 0.28 -1.00 0.00 0.00 179.01 178.22 3max h VAL 292 N 0.09 0.68 -0.44 3.13 2.07 -0.99 -2.47 116.25 118.32 3max h VAL 292 Ca 0.21 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.72 3max h VAL 292 Cb 0.30 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 3max h VAL 292 CO -0.36 0.00 0.26 0.58 0.02 0.00 0.00 177.57 178.08 3max h VAL 293 N -0.31 1.14 -0.97 2.57 2.07 -1.22 -2.48 116.25 117.05 3max h VAL 293 Ca 0.01 -0.34 0.27 0.00 0.82 0.00 0.00 66.70 67.46 3max h VAL 293 Cb 0.30 0.57 -0.14 0.00 -1.52 0.00 0.00 31.29 30.50 3max h VAL 293 CO -0.04 0.15 0.51 0.11 0.02 0.00 0.00 177.57 178.31 3max h LYS 294 N 0.59 0.38 0.00 1.57 1.57 -0.93 -2.45 116.57 117.29 3max h LYS 294 Ca 0.16 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 3max h LYS 294 Cb 0.01 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.23 3max h LYS 294 CO -0.03 0.25 0.00 1.79 -0.57 0.00 0.00 179.45 180.89 3max h THR 295 N 0.39 0.00 0.00 -0.16 1.35 -0.96 -2.13 112.91 111.40 3max h THR 295 Ca 0.66 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 66.31 3max h THR 295 Cb 1.38 1.09 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 3max h THR 295 CO -0.56 0.00 0.00 0.49 -0.25 0.00 0.00 175.52 175.20 3max n PHE 296 N -2.82 0.00 -3.75 4.73 3.72 -0.92 -4.91 117.46 113.51 3max n PHE 296 Ca -0.01 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.15 3max n PHE 296 Cb 0.17 -0.47 0.04 0.00 -0.94 0.00 0.00 39.48 38.28 3max n PHE 296 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3max n ASN 297 N -1.47 -3.13 -4.65 4.37 3.02 -0.80 -5.00 115.26 107.59 3max n ASN 297 Ca 0.06 -0.76 -0.28 0.00 -0.03 0.00 0.00 54.58 53.57 3max n ASN 297 Cb 0.24 -4.18 -0.08 0.00 -0.61 0.00 0.00 39.78 35.15 3max n ASN 297 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3max s LEU 298 N -6.95 3.28 -0.04 3.41 1.43 -1.26 -5.09 118.68 113.47 3max s LEU 298 Ca 0.31 -0.35 -0.37 0.00 -1.03 0.00 0.00 54.13 52.68 3max s LEU 298 Cb -0.15 -1.98 -0.16 0.00 0.03 0.00 0.00 46.19 43.93 3max s LEU 298 CO 0.80 0.13 1.52 -2.65 0.23 0.00 0.00 176.35 176.38 3max n PRO 299 N 0.20 1.28 -4.00 1.29 -0.02 -1.26 -4.85 135.00 127.64 3max n PRO 299 Ca -0.11 0.47 -0.23 0.00 -2.02 0.00 0.00 63.50 61.61 3max n PRO 299 Cb 0.54 -2.14 -0.17 0.00 -0.02 0.00 0.00 33.50 31.71 3max n PRO 299 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3max s LEU 300 N 1.72 1.06 -0.29 2.45 2.96 -0.63 -1.33 118.68 124.63 3max s LEU 300 Ca 0.89 -0.17 -0.09 0.00 -0.22 0.00 0.00 54.13 54.54 3max s LEU 300 Cb -0.96 -0.58 -0.02 0.00 0.50 0.00 0.00 46.19 45.13 3max s LEU 300 CO 0.53 -0.11 0.13 -0.22 -1.32 0.00 0.00 176.35 175.36 3max s LEU 301 N 1.46 3.90 -0.19 -0.68 2.96 -0.22 -1.31 118.68 124.60 3max s LEU 301 Ca -0.02 -0.35 -0.05 0.00 -0.22 0.00 0.00 54.13 53.49 3max s LEU 301 Cb -0.13 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 3max s LEU 301 CO -0.03 -0.12 0.01 -0.04 -1.32 0.00 0.00 176.35 174.84 3max s MET 302 N 1.64 3.71 0.29 1.98 -1.94 0.15 -0.38 119.30 124.75 3max s MET 302 Ca 0.06 -0.48 0.10 0.00 -1.71 0.00 0.00 55.69 53.66 3max s MET 302 Cb -0.16 -3.09 -0.06 0.00 2.01 0.00 0.00 34.83 33.53 3max s MET 302 CO 0.06 0.11 -0.14 -0.51 -0.01 0.00 0.00 175.02 174.53 3max s LEU 303 N 0.76 2.62 0.00 -0.03 1.43 0.02 -0.98 118.68 122.50 3max s LEU 303 Ca 0.01 -1.10 0.00 0.00 -1.03 0.00 0.00 54.13 52.00 3max s LEU 303 Cb -0.14 -0.97 0.00 0.00 0.03 0.00 0.00 46.19 45.11 3max s LEU 303 CO 0.02 -0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.10 3max n GLY 304 N -0.65 0.90 0.00 -3.19 0.00 -1.00 -0.81 105.19 100.45 3max n GLY 304 Ca -0.05 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.60 3max n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3max n GLY 305 N 5.00 -0.19 3.07 -0.02 0.00 -1.03 -3.29 105.19 108.73 3max n GLY 305 Ca 0.00 -0.86 -0.27 0.00 0.00 0.00 0.00 46.02 44.90 3max n GLY 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3max n GLY 306 N 0.00 -2.90 0.00 -0.02 0.00 -1.26 -4.67 105.19 96.34 3max n GLY 306 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3max n GLY 306 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3max n GLY 307 N -4.12 3.43 0.00 -0.02 0.00 -1.26 -0.26 105.19 102.97 3max n GLY 307 Ca 0.13 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3max n GLY 307 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3max n TYR 308 N 0.00 0.00 -3.43 1.61 4.02 -1.26 -4.82 117.16 113.29 3max n TYR 308 Ca 0.00 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.45 3max n TYR 308 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.26 3max n TYR 308 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3max s THR 309 N -0.36 4.76 0.18 -0.72 2.01 -1.26 -4.47 115.64 115.77 3max s THR 309 Ca 0.00 -1.69 0.14 0.00 0.31 0.00 0.00 61.69 60.45 3max s THR 309 Cb 0.00 -4.08 0.03 0.00 0.01 0.00 0.00 72.50 68.46 3max s THR 309 CO 0.00 -0.84 1.61 0.16 -0.69 0.00 0.00 174.62 174.87 3max h ILE 310 N 5.95 1.20 -0.98 1.82 3.07 -1.98 -1.31 117.51 125.28 3max h ILE 310 Ca -0.24 -2.03 0.06 0.00 1.55 0.00 0.00 64.86 64.20 3max h ILE 310 Cb 1.08 2.15 -0.06 0.00 -0.27 0.00 0.00 36.82 39.72 3max h ILE 310 CO 0.94 0.54 0.64 0.08 -1.05 0.00 0.00 178.15 179.30 3max h ARG 311 N 0.00 1.13 0.02 0.16 0.11 -1.94 -1.41 114.38 112.46 3max h ARG 311 Ca -0.01 -0.07 -0.21 0.00 0.10 0.00 0.00 59.98 59.80 3max h ARG 311 Cb 1.11 -0.26 -0.02 0.00 1.11 0.00 0.00 29.97 31.92 3max h ARG 311 CO 0.07 0.75 -0.95 -0.91 0.10 0.00 0.00 179.97 179.03 3max h ASN 312 N 1.16 0.14 -0.32 0.08 2.35 -1.64 -2.65 115.58 114.71 3max h ASN 312 Ca 0.42 -0.13 0.02 0.00 -0.55 0.00 0.00 56.30 56.06 3max h ASN 312 Cb 0.14 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 3max h ASN 312 CO -0.16 1.01 0.17 0.58 -1.65 0.00 0.00 177.43 177.38 3max h VAL 313 N 0.04 1.00 -0.65 2.81 2.07 -1.22 0.12 116.25 120.43 3max h VAL 313 Ca -0.04 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.37 3max h VAL 313 Cb 1.64 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.00 3max h VAL 313 CO 0.14 0.06 0.42 0.00 0.02 0.00 0.00 177.57 178.21 3max h ALA 314 N 1.16 0.82 -0.19 1.67 0.00 -1.20 -1.39 119.26 120.13 3max h ALA 314 Ca 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3max h ALA 314 Cb 0.04 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3max h ALA 314 CO -0.08 0.27 0.09 0.00 0.00 0.00 0.00 179.25 179.52 3max h ARG 315 N 0.88 0.27 0.04 0.00 3.08 -1.34 -1.74 114.38 115.57 3max h ARG 315 Ca 0.24 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.24 3max h ARG 315 Cb -0.08 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.92 3max h ARG 315 CO -0.05 0.30 -0.02 0.00 -1.07 0.00 0.00 179.97 179.13 3max h TRP 317 N -0.14 0.00 0.11 0.00 6.55 -1.31 -0.60 115.95 120.56 3max h TRP 317 Ca -0.01 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 3max h TRP 317 Cb 0.12 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.42 3max h TRP 317 CO -0.05 0.56 -0.05 1.15 -1.05 0.00 0.00 178.44 179.00 3max h THR 318 N 0.00 0.98 -0.77 1.49 2.02 -1.17 -1.02 112.91 114.45 3max h THR 318 Ca -0.01 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 3max h THR 318 Cb 1.30 1.20 -0.04 0.00 -1.74 0.00 0.00 68.15 68.87 3max h THR 318 CO 0.07 0.08 0.39 0.22 0.37 0.00 0.00 175.52 176.66 3max h TYR 319 N -0.30 1.08 0.00 3.16 3.20 -0.96 -0.89 116.97 122.26 3max h TYR 319 Ca -0.01 -0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.71 3max h TYR 319 Cb 0.25 -0.34 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 3max h TYR 319 CO -0.02 0.77 -0.51 0.93 -1.64 0.00 0.00 178.16 177.69 3max h GLU 320 N 1.09 0.00 -0.40 1.82 5.08 -1.07 0.29 114.58 121.39 3max h GLU 320 Ca 0.27 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.58 3max h GLU 320 Cb 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3max h GLU 320 CO -0.04 0.51 0.04 1.15 -1.00 0.00 0.00 179.01 179.68 3max h THR 321 N 0.00 1.25 -0.81 1.13 2.02 -0.74 -1.25 112.91 114.50 3max h THR 321 Ca -0.01 -0.91 -0.03 0.00 0.77 0.00 0.00 66.41 66.23 3max h THR 321 Cb 0.98 1.07 -0.04 0.00 -1.74 0.00 0.00 68.15 68.42 3max h THR 321 CO 0.07 0.31 0.39 0.00 0.37 0.00 0.00 175.52 176.66 3max h ALA 322 N 0.91 1.16 -0.35 6.16 0.00 -0.36 -1.86 119.26 124.91 3max h ALA 322 Ca 0.12 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3max h ALA 322 Cb 0.40 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3max h ALA 322 CO 0.01 0.64 0.21 0.28 0.00 0.00 0.00 179.25 180.39 3max h VAL 323 N 1.15 1.12 -0.58 0.00 2.07 -0.35 0.11 116.25 119.76 3max h VAL 323 Ca 0.28 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.57 3max h VAL 323 Cb 0.11 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 3max h VAL 323 CO -0.04 0.12 0.39 0.00 0.02 0.00 0.00 177.57 178.06 3max h ALA 324 N 1.09 1.78 -0.01 1.67 0.00 -0.75 -0.99 119.26 122.06 3max h ALA 324 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3max h ALA 324 Cb 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.64 3max h ALA 324 CO -0.02 0.13 -0.02 1.28 0.00 0.00 0.00 179.25 180.62 3max n LEU 325 N -4.47 0.88 -4.08 0.00 4.77 -0.74 -4.62 117.00 108.73 3max n LEU 325 Ca 0.08 -0.27 -0.31 0.00 -0.03 0.00 0.00 56.01 55.48 3max n LEU 325 Cb 0.20 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.25 3max n LEU 325 CO 0.34 0.15 -0.11 0.47 -1.33 0.00 0.00 177.39 176.92 3max n ASP 326 N -0.37 -2.15 -4.11 -1.43 9.92 -0.37 -4.89 116.55 113.14 3max n ASP 326 Ca 0.20 -0.99 -0.33 0.00 -0.53 0.00 0.00 54.79 53.14 3max n ASP 326 Cb 0.27 -2.99 -0.15 0.00 -0.64 0.00 0.00 41.12 37.61 3max n ASP 326 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3max s GLU 328 N 1.20 4.36 0.05 0.00 2.02 -1.26 -4.49 118.70 120.58 3max s GLU 328 Ca -0.04 1.98 0.07 0.00 0.02 0.00 0.00 54.97 57.00 3max s GLU 328 Cb -0.18 -3.28 -0.03 0.00 0.10 0.00 0.00 34.13 30.75 3max s GLU 328 CO -0.07 -0.37 -0.20 0.96 0.02 0.00 0.00 175.26 175.60 3max s ILE 329 N 1.05 1.58 0.62 -1.63 -4.36 -1.26 -5.13 121.20 112.06 3max s ILE 329 Ca 0.62 -1.19 -0.17 0.00 -0.26 0.00 0.00 60.65 59.65 3max s ILE 329 Cb -0.35 -1.38 -0.02 0.00 1.25 0.00 0.00 42.46 41.96 3max s ILE 329 CO 0.30 0.15 1.17 -2.16 0.24 0.00 0.00 174.94 174.64 3max s PRO 330 N -1.22 2.89 0.34 0.37 0.04 -1.26 -4.92 135.00 131.24 3max s PRO 330 Ca 0.06 1.67 0.10 0.00 0.04 0.00 0.00 61.00 62.87 3max s PRO 330 Cb -0.09 -1.94 0.61 0.00 0.04 0.00 0.00 34.50 33.13 3max s PRO 330 CO 0.02 -1.23 1.78 -0.97 0.04 0.00 0.00 177.00 176.64 3max h ASN 331 N 0.58 0.11 -2.76 6.66 -1.24 -2.00 -3.43 115.58 113.52 3max h ASN 331 Ca -0.49 -0.04 -0.56 0.00 0.71 0.00 0.00 56.30 55.92 3max h ASN 331 Cb 1.28 -0.03 -0.02 0.00 0.73 0.00 0.00 38.32 40.27 3max h ASN 331 CO 0.54 0.48 1.02 -0.70 -1.29 0.00 0.00 177.43 177.48 3max s GLU 332 N -4.20 4.15 0.21 6.67 2.56 -1.26 0.09 118.70 126.92 3max s GLU 332 Ca -0.04 1.90 -0.30 0.00 0.00 0.00 0.00 54.97 56.53 3max s GLU 332 Cb 0.14 -3.90 -0.09 0.00 2.00 0.00 0.00 34.13 32.28 3max s GLU 332 CO 0.74 -0.85 1.34 -0.51 -0.56 0.00 0.00 175.26 175.42 3max s LEU 333 N 3.97 4.41 0.57 2.70 1.43 -0.74 -4.89 118.68 126.14 3max s LEU 333 Ca 0.65 2.47 -0.17 0.00 -1.03 0.00 0.00 54.13 56.05 3max s LEU 333 Cb -0.27 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.29 3max s LEU 333 CO 0.23 -0.56 1.07 -2.16 0.23 0.00 0.00 176.35 175.17 3max s PRO 334 N -0.23 3.33 0.51 1.29 0.04 -1.26 -4.99 135.00 133.68 3max s PRO 334 Ca 0.57 1.34 -0.21 0.00 0.04 0.00 0.00 61.00 62.74 3max s PRO 334 Cb -0.38 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.05 3max s PRO 334 CO 0.40 -0.82 0.78 0.98 0.04 0.00 0.00 177.00 178.38 3max n TYR 335 N -1.75 0.27 -3.83 0.56 4.19 -1.26 -4.98 117.16 110.36 3max n TYR 335 Ca 0.10 0.50 -0.06 0.00 3.31 0.00 0.00 57.90 61.75 3max n TYR 335 Cb 0.52 -2.09 -0.01 0.00 0.49 0.00 0.00 39.34 38.26 3max n TYR 335 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 3max s ASN 336 N -1.02 -0.16 0.22 2.98 2.20 -1.26 -4.86 114.94 113.04 3max s ASN 336 Ca 0.68 -0.70 0.20 0.00 -0.94 0.00 0.00 52.86 52.10 3max s ASN 336 Cb -0.50 0.69 0.91 0.00 -2.00 0.00 0.00 41.25 40.35 3max s ASN 336 CO 0.54 -1.31 1.60 0.47 -2.94 0.00 0.00 177.10 175.45 3max n ASP 337 N -0.74 0.49 -0.55 3.54 8.00 -1.26 -2.58 116.55 123.46 3max n ASP 337 Ca -0.05 0.66 0.07 0.00 0.71 0.00 0.00 54.79 56.17 3max n ASP 337 Cb 0.60 -0.75 0.16 0.00 -0.02 0.00 0.00 41.12 41.11 3max n ASP 337 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3max n TYR 338 N -2.09 0.00 -0.28 1.24 4.02 -1.26 -4.85 117.16 113.94 3max n TYR 338 Ca 0.01 -1.20 0.09 0.00 -0.01 0.00 0.00 57.90 56.80 3max n TYR 338 Cb 0.14 -0.20 0.33 0.00 -0.02 0.00 0.00 39.34 39.59 3max n TYR 338 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 3max h PHE 339 N 0.69 0.91 0.00 -0.72 3.04 -1.88 -0.65 116.94 118.33 3max h PHE 339 Ca -0.02 0.03 -0.02 0.00 3.98 0.00 0.00 57.97 61.94 3max h PHE 339 Cb 1.11 -0.29 -0.00 0.00 2.56 0.00 0.00 35.95 39.33 3max h PHE 339 CO 0.47 0.37 -0.07 1.05 -2.02 0.00 0.00 178.31 178.11 3max h GLU 340 N 0.80 0.00 0.00 1.11 9.09 -1.88 -2.21 114.58 121.48 3max h GLU 340 Ca 0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.85 3max h GLU 340 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.67 3max h GLU 340 CO -0.20 0.07 0.00 1.88 0.05 0.00 0.00 179.01 180.81 3max h TYR 341 N 0.00 0.00 -0.46 2.06 -1.99 -1.51 -3.12 116.97 111.96 3max h TYR 341 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3max h TYR 341 Cb 0.23 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.96 3max h TYR 341 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 178.16 179.35 3max n PHE 342 N -3.07 0.60 -1.19 4.88 3.01 -0.83 -4.77 117.46 116.09 3max n PHE 342 Ca -0.01 -0.30 -0.29 0.00 1.01 0.00 0.00 57.45 57.87 3max n PHE 342 Cb 0.23 0.00 0.16 0.00 -0.01 0.00 0.00 39.48 39.86 3max n PHE 342 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3max s GLY 343 N -1.33 1.59 0.00 1.37 0.00 -1.18 -0.81 107.32 106.96 3max s GLY 343 Ca 0.40 -0.21 0.28 0.00 0.00 0.00 0.00 44.72 45.19 3max s GLY 343 CO 0.31 0.34 1.72 -1.55 0.00 0.00 0.00 173.10 173.92 3max n PRO 344 N -4.03 0.54 0.02 2.90 -0.04 -1.26 -4.76 135.00 128.38 3max n PRO 344 Ca 0.06 -0.24 -0.22 0.00 -0.04 0.00 0.00 63.50 63.07 3max n PRO 344 Cb 0.56 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.39 3max n PRO 344 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 3max h ASP 345 N 0.58 0.45 -3.03 3.54 2.03 -2.00 -3.48 116.42 114.50 3max h ASP 345 Ca 0.00 -0.94 -0.33 0.00 -0.73 0.00 0.00 57.03 55.03 3max h ASP 345 Cb 0.43 -0.15 0.02 0.00 -0.83 0.00 0.00 39.33 38.80 3max h ASP 345 CO 0.00 1.83 -0.46 0.49 -1.03 0.00 0.00 179.24 180.07 3max n PHE 346 N -3.56 -1.19 -4.21 4.15 3.01 0.01 -4.99 117.46 110.69 3max n PHE 346 Ca -0.30 0.21 -0.24 0.00 1.01 0.00 0.00 57.45 58.13 3max n PHE 346 Cb 1.04 -3.60 -0.07 0.00 -0.01 0.00 0.00 39.48 36.84 3max n PHE 346 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3max s LYS 347 N -5.15 2.53 -0.00 -1.08 -0.14 -1.26 -1.78 119.74 112.85 3max s LYS 347 Ca 0.12 -1.19 -0.22 0.00 -1.36 0.00 0.00 55.97 53.32 3max s LYS 347 Cb -0.05 -2.36 -0.19 0.00 -1.68 0.00 0.00 37.83 33.55 3max s LYS 347 CO 0.15 0.41 1.21 1.25 -0.76 0.00 0.00 175.35 177.62 3max h LEU 348 N 2.09 0.29-10.17 3.17 5.85 -0.65 -3.46 115.31 112.44 3max h LEU 348 Ca -0.46 -0.60 -0.48 0.00 0.84 0.00 0.00 57.88 57.17 3max h LEU 348 Cb 1.23 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 42.18 3max h LEU 348 CO 0.60 0.84 0.24 -1.00 -0.34 0.00 0.00 178.44 178.78 3max s HIS 349 N -3.82 3.46 0.28 1.25 3.76 -1.26 -4.84 115.29 114.12 3max s HIS 349 Ca -0.15 1.24 0.11 0.00 -0.15 0.00 0.00 55.06 56.11 3max s HIS 349 Cb 0.03 -2.60 -0.05 0.00 1.11 0.00 0.00 32.58 31.07 3max s HIS 349 CO 0.75 -0.23 -0.16 0.96 -0.85 0.00 0.00 174.74 175.20 3max s ILE 350 N -2.50 2.64 -0.04 0.60 -4.36 -1.26 -5.06 121.20 111.23 3max s ILE 350 Ca 0.55 -2.32 -0.04 0.00 -0.26 0.00 0.00 60.65 58.58 3max s ILE 350 Cb -0.10 -2.41 -0.04 0.00 1.25 0.00 0.00 42.46 41.16 3max s ILE 350 CO 0.32 -0.39 0.16 -0.44 0.24 0.00 0.00 174.94 174.83 3max s SER 351 N -3.54 6.30 0.72 4.36 0.01 -1.26 -4.69 113.70 115.59 3max s SER 351 Ca 0.30 0.36 -0.11 0.00 1.31 0.00 0.00 55.95 57.81 3max s SER 351 Cb -0.05 -1.98 0.03 0.00 0.21 0.00 0.00 66.02 64.23 3max s SER 351 CO 0.16 0.31 1.07 -2.16 0.41 0.00 0.00 173.24 173.03 3max s PRO 352 N -1.65 2.65 0.80 12.44 0.04 -1.26 -4.96 135.00 143.08 3max s PRO 352 Ca 0.23 1.07 -0.09 0.00 0.04 0.00 0.00 61.00 62.25 3max s PRO 352 Cb -0.12 -1.95 0.12 0.00 0.04 0.00 0.00 34.50 32.59 3max s PRO 352 CO 0.14 -1.33 1.13 -1.54 0.04 0.00 0.00 177.00 175.44 3max s SER 353 N -3.54 4.13 -0.02 6.66 1.04 -1.26 -4.99 113.70 115.72 3max s SER 353 Ca 0.60 0.28 0.06 0.00 0.48 0.00 0.00 55.95 57.37 3max s SER 353 Cb -0.16 -0.66 0.21 0.00 0.10 0.00 0.00 66.02 65.51 3max s SER 353 CO 0.54 -2.06 1.07 -0.46 0.98 0.00 0.00 173.24 173.31 3max n ASN 354 N -3.23 1.58 -4.75 7.02 2.04 -1.26 -4.96 115.26 111.71 3max n ASN 354 Ca 0.12 -2.09 -0.37 0.00 -0.44 0.00 0.00 54.58 51.80 3max n ASN 354 Cb 0.60 -0.28 0.04 0.00 -2.53 0.00 0.00 39.78 37.61 3max n ASN 354 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3max s MET 355 N -1.65 2.92 0.25 -3.83 0.23 -1.26 -4.93 119.30 111.02 3max s MET 355 Ca 0.15 1.98 -0.30 0.00 -1.03 0.00 0.00 55.69 56.49 3max s MET 355 Cb 0.09 -1.99 -0.09 0.00 -1.53 0.00 0.00 34.83 31.31 3max s MET 355 CO 0.08 -1.29 1.20 0.99 -2.03 0.00 0.00 175.02 173.97 3max s THR 356 N -1.47 3.34 -0.53 3.16 2.01 -1.26 -4.98 115.64 115.90 3max s THR 356 Ca 0.77 1.23 -0.24 0.00 0.31 0.00 0.00 61.69 63.77 3max s THR 356 Cb -0.34 -3.79 0.04 0.00 0.01 0.00 0.00 72.50 68.42 3max s THR 356 CO 0.38 0.25 0.92 0.21 -0.69 0.00 0.00 174.62 175.69 3max s ASN 357 N -0.31 6.35 0.00 3.53 2.47 -1.26 -4.18 114.94 121.55 3max s ASN 357 Ca 0.50 -0.31 0.20 0.00 0.42 0.00 0.00 52.86 53.66 3max s ASN 357 Cb -0.34 -2.43 0.91 0.00 -1.45 0.00 0.00 41.25 37.94 3max s ASN 357 CO 0.41 -1.18 1.64 0.00 -3.72 0.00 0.00 177.10 174.25 3max n GLN 358 N 7.34 0.11 -2.96 0.43 1.13 -0.66 -4.53 117.38 118.24 3max n GLN 358 Ca 0.02 0.14 -0.44 0.00 -1.94 0.00 0.00 57.00 54.78 3max n GLN 358 Cb 0.48 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.29 3max n GLN 358 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3max s ASN 359 N -2.84 6.36 0.66 1.08 0.01 -1.26 -4.89 114.94 114.06 3max s ASN 359 Ca 0.13 -1.53 -0.15 0.00 -0.71 0.00 0.00 52.86 50.60 3max s ASN 359 Cb 0.13 -2.38 -0.00 0.00 0.41 0.00 0.00 41.25 39.41 3max s ASN 359 CO 0.34 -1.20 1.12 0.42 -1.51 0.00 0.00 177.10 176.27 3max s THR 360 N 3.12 3.15 0.29 1.60 -4.23 -1.26 -4.82 115.64 113.48 3max s THR 360 Ca 0.23 0.55 0.03 0.00 -1.18 0.00 0.00 61.69 61.32 3max s THR 360 Cb -0.14 -3.08 0.29 0.00 1.34 0.00 0.00 72.50 70.91 3max s THR 360 CO 0.02 -0.31 1.83 -0.65 -0.54 0.00 0.00 174.62 174.96 3max h PRO 361 N 0.09 0.89 -0.42 3.99 0.11 -1.97 -0.97 132.00 133.73 3max h PRO 361 Ca -0.47 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 3max h PRO 361 Cb 1.25 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 3max h PRO 361 CO 0.54 0.59 0.23 0.93 -0.21 0.00 0.00 178.00 180.08 3max h GLU 362 N 0.92 0.58 -0.18 1.05 3.07 -1.99 -1.02 114.58 117.01 3max h GLU 362 Ca 0.51 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 59.32 3max h GLU 362 Cb 0.60 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.38 3max h GLU 362 CO -0.28 0.47 0.08 -0.92 -1.40 0.00 0.00 179.01 176.95 3max h TYR 363 N 0.54 0.14 -0.54 4.33 5.03 -1.79 -0.38 116.97 124.31 3max h TYR 363 Ca 0.15 0.01 0.07 0.00 2.58 0.00 0.00 58.73 61.54 3max h TYR 363 Cb 0.05 -0.04 -0.06 0.00 1.55 0.00 0.00 36.73 38.24 3max h TYR 363 CO -0.02 0.08 0.21 0.52 -1.32 0.00 0.00 178.16 177.63 3max h MET 364 N 0.17 0.39 -0.19 1.82 2.86 -0.91 -1.65 114.93 117.43 3max h MET 364 Ca 0.07 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.57 3max h MET 364 Cb 0.03 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 3max h MET 364 CO -0.06 0.26 -0.39 0.93 1.06 0.00 0.00 176.91 178.71 3max h GLU 365 N 0.40 0.42 -0.22 1.72 4.39 -0.99 -2.44 114.58 117.86 3max h GLU 365 Ca 0.26 -0.20 -0.10 0.00 0.34 0.00 0.00 59.36 59.66 3max h GLU 365 Cb 0.28 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.92 3max h GLU 365 CO -0.25 0.75 -0.24 -0.22 -1.16 0.00 0.00 179.01 177.89 3max h LYS 366 N 0.35 0.55 -0.49 2.33 1.63 -0.67 -0.98 116.57 119.30 3max h LYS 366 Ca 0.03 -0.30 -0.04 0.00 -0.85 0.00 0.00 60.65 59.49 3max h LYS 366 Cb 0.85 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.47 3max h LYS 366 CO 0.07 0.89 0.14 0.82 -3.45 0.00 0.00 179.45 177.92 3max h ILE 367 N 0.24 1.23 -0.76 2.00 1.08 -1.31 -1.63 117.51 118.36 3max h ILE 367 Ca 0.03 -0.79 0.08 0.00 -0.39 0.00 0.00 64.86 63.79 3max h ILE 367 Cb 0.80 0.82 -0.07 0.00 -3.07 0.00 0.00 36.82 35.30 3max h ILE 367 CO 0.06 0.29 0.43 0.50 -0.69 0.00 0.00 178.15 178.74 3max h LYS 368 N 0.66 0.74 -0.52 2.37 3.64 -1.40 -0.08 116.57 121.97 3max h LYS 368 Ca 0.16 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 3max h LYS 368 Cb 0.29 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 3max h LYS 368 CO -0.00 0.49 0.17 0.37 -2.27 0.00 0.00 179.45 178.20 3max h GLN 369 N 0.76 0.80 -0.71 1.90 5.75 -0.85 -0.31 115.11 122.45 3max h GLN 369 Ca 0.36 -0.17 -0.02 0.00 -0.15 0.00 0.00 58.65 58.67 3max h GLN 369 Cb 0.28 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 3max h GLN 369 CO -0.22 0.74 0.36 0.00 -2.65 0.00 0.00 178.83 177.06 3max h ARG 370 N 0.71 1.00 -0.66 1.69 3.08 -0.76 -2.42 114.38 117.02 3max h ARG 370 Ca 0.17 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 3max h ARG 370 Cb 0.26 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 3max h ARG 370 CO -0.01 0.77 0.17 -0.07 -1.07 0.00 0.00 179.97 179.77 3max h LEU 371 N 0.98 0.97 -1.27 3.04 3.38 -0.77 -2.35 115.31 119.28 3max h LEU 371 Ca 0.25 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3max h LEU 371 Cb 0.08 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 3max h LEU 371 CO -0.03 0.93 0.47 -0.26 0.09 0.00 0.00 178.44 179.63 3max h PHE 372 N 0.99 0.92 -0.66 1.13 -1.00 -0.87 -1.44 116.94 116.00 3max h PHE 372 Ca 0.21 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.99 3max h PHE 372 Cb 0.33 -0.31 -0.03 0.00 3.61 0.00 0.00 35.95 39.55 3max h PHE 372 CO 0.02 0.59 0.36 0.93 -1.61 0.00 0.00 178.31 178.60 3max h GLU 373 N 0.99 0.92 -0.59 1.51 5.08 -0.93 -2.35 114.58 119.22 3max h GLU 373 Ca 0.26 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 3max h GLU 373 Cb -0.10 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 28.95 3max h GLU 373 CO -0.06 0.70 0.20 -0.91 -1.00 0.00 0.00 179.01 177.95 3max h ASN 374 N 0.90 0.84 0.46 1.42 2.35 -1.19 -2.89 115.58 117.47 3max h ASN 374 Ca 0.23 -0.20 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 3max h ASN 374 Cb 0.05 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.20 3max h ASN 374 CO -0.04 0.81 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.40 3max h LEU 375 N 0.82 0.00 -1.83 1.61 3.38 -0.99 -1.45 115.31 116.85 3max h LEU 375 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3max h LEU 375 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3max h LEU 375 CO -0.01 0.08 0.00 0.03 0.09 0.00 0.00 178.44 178.63 3max h ARG 376 N 0.00 0.00 -0.00 1.13 3.08 -1.20 -2.66 114.38 114.73 3max h ARG 376 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3max h ARG 376 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 3max h ARG 376 CO 0.01 0.00 -0.01 -1.33 -1.07 0.00 0.00 179.97 177.57 3max n MET 377 N -2.93 0.15 0.00 0.04 2.81 -0.55 -5.14 117.12 111.51 3max n MET 377 Ca -0.00 -0.00 0.05 0.00 -1.81 0.00 0.00 57.70 55.93 3max n MET 377 Cb 0.21 -1.50 0.27 0.00 -0.71 0.00 0.00 33.22 31.49 3max n MET 377 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76